硫代己酸烯丙酯 allyl thiohexanoate
s-prop-2-en-1-yl丁硫醇酯 S-prop-2-en-1-yl butanethioate

供应商赞助商 Supplier Sponsors

Name:s-prop-2-en-1-yl丁硫醇酯 S-prop-2-en-1-yl butanethioate
CAS号 CAS Number: 156420-69-8Picture of molecule3D/INCHI
FDA UNII:8KK7J07P1Z
XlogP3-AA: 3.60(估 est)
分子量 Molecular Weight:172.29072000
式 Formula:c9 h16 o s C9 H16 O S
核磁共振预测器 NMR Predictor:预测(适用于Chrome或Firefox) Predict (works with chrome or firefox)
efsa / jecfa评论 EFSA/JECFA Comments:
(调味品行业 (Flavour Industry, 2006).
类别 Category:flavoring agents
 
美国 US/欧盟 EU/ fda / jecfa / fema / Flavis / 文献 Scholar /专利 Patent :
谷歌学术 Google Scholar:搜索 Search
谷歌书 Google Books:搜索 Search
谷歌学术 Google Scholar: with word "volatile"搜索 Search
谷歌学术 Google Scholar: with word "flavor"搜索 Search
谷歌学术 Google Scholar: with word "odor"搜索 Search
调香师和调味师 Perfumer and Flavorist:搜索 Search
谷歌专利 Google Patents:搜索 Search
美国专利 US Patents:搜索 Search
欧盟专利 EU Patents:搜索 Search
pubchem专利 Pubchem Patents:搜索 Search
jecfa食品调味料 JECFA Food Flavoring:1681硫代己酸烯丙酯 1681 allyl thiohexanoate
Flavis号码 FLAVIS Number:12.275(旧) 12.275 (Old)
dg sante食品调味料 DG SANTE Food Flavourings:12.275烯丙基硫代己酸 12.275 allyl thiohexanoate
fema号 FEMA Number:4076 硫代己酸烯丙酯 allyl thiohexanoate
自由贸易区 FDA:不再提供这七种合成调味剂的使用 No longer provide for the use of these seven synthetic flavoring substances
fda mainterm(satf) FDA Mainterm (SATF):156420-69-8 ; ALLYL THIOHEXANOATE
 
物理性质 Physical Properties:
出现 Appearance: 无色透明液体(估 est)
化验 Assay: 98.00至100.00 98.00 to 100.00
食品化学品法典列表 Food Chemicals Codex Listed: No
比重 Specific Gravity:0.93000 to 0.93400 @ 25.00 °C.
磅每加仑-(估 est)。 : 7.739 to 7.772
折光率 Refractive Index:1.47300 to 1.47900 @ 20.00 °C.
沸点 Boiling Point: 195.00 to 196.00 °C. @ 760.00 mm 汞 Hg
蒸汽压力 Vapor Pressure:0.145000 毫米汞柱 mm汞 Hg @ 25.00 °C. (估 est)
闪点 Flash Point: 165.00 °F. tcc TCC ( 73.80 °C. ) (估 est)
logp(o / w) logP (o/w): 3.678(估 est)
溶于 Soluble in:
 alcohol
 三醋精 triacetin
 水 water, 1422 mg / l @ 25°c(估 est)
不溶于 Insoluble in:
 水 water
类似物品 Similar Items:note
己酸烯丙酯 allyl hexanoate
己酸戊酯 amyl hexanoate
己酸异戊酯 isoamyl hexanoate
对茴香酸己酯 para-anisyl hexanoate
己酸苄酯 benzyl hexanoate
己酸丁酯 butyl hexanoate
己酸异丁酯 isobutyl hexanoate
己酸仲丁酯 sec-butyl hexanoate
肉桂酸cinnamyl hexanoate
己酸香茅酯 citronellyl hexanoate
己酸间甲苯酯 meta-cresyl hexanoate
对甲酚己酸酯 para-cresyl hexanoate
己酸环己酯 cyclohexyl hexanoate
己酸癸酯 decyl hexanoate
己基二甲基苄基己酸酯 dimethyl benzyl carbinyl hexanoate
2-乙酰基己酸乙酯 ethyl 2-acetyl hexanoate
己酸乙酯 ethyl hexanoate
己酸糠酯 furfuryl hexanoate
香叶酸香叶酯 geranyl hexanoate
己酸庚酯 heptyl hexanoate
己酸仲庚酯 sec-heptyl hexanoate
(e)-3-己烯-1-基己酸酯 (E)-3-hexen-1-yl hexanoate
(e)-2-己烯-1-基己酸酯 (E)-2-hexen-1-yl hexanoate
(z)-3-己烯-1-基己酸酯 (Z)-3-hexen-1-yl hexanoate
己酸己酯 hexyl hexanoateFL/FR
己酸芳基酯 linalyl hexanoate
己酸薄荷酯 menthyl hexanoate
己酸3-巯基己酯 3-mercaptohexyl hexanoate
己酸2-甲基丁酯 2-methyl butyl hexanoate
己酸甲酯 methyl hexanoate
硫代己酸甲酯 methyl thiohexanoate
己酸橙花酯 neryl hexanoate
己酸辛酯 octyl hexanoate
(z)-2-戊烯-1-基己酸酯 (Z)-2-penten-1-yl hexanoate
己酸苯乙酯 phenethyl hexanoate
己酸3-苯基丙酯 3-phenyl propyl hexanoate
异戊酸异戊酯 prenyl hexanoate
己酸丙酯 propyl hexanoate
己酸异丙酯 isopropyl hexanoate
己酸硫酯 sulfuryl hexanoate
 
感官特性 Organoleptic Properties:
气味类型 Odor Type: sulfurous
气味强度 Odor Strength:高 high ,
建议在0.01%或更少的溶液中闻到 recommend smelling in a 0.01 % solution or less
fruity sulfurous tropical
气味描述 Odor Description:at 0.01 % in propylene glycol. 果味含硫热带 fruity sulfurous tropical
来自其他 的气味和/或风味描述(如果找到)。 Odor and/or flavor descriptions from others (if found).
 
化妆品信息 Cosmetic Information:
没找到 None found
 
供应商 Suppliers:
艾克辛 Axsyn
仅供实验/研究使用。 For experimental / research use only.
己硫酸 Hexanethioic acid,s-2-丙烯-1-基酯 S-2-propen-1-yl ester
Parchem Parchem
硫代己酸烯丙酯 allyl thiohexanoate
化学资源协会 Chemical sources Association Inc
需要这个物品来调味/食用吗? Need This Item for Flavor/Food?: 您 You can contact the 化学资源协会 Chemical sources Association Inc
 
安全信息 Safety Information:
 
危害识别 Hazards identification
 
物质或混合物的分类 Classification of the substance or mixture
根据29 cfr 1910(osha hcs)进行ghs分类 GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
没有找到。 None found.
ghs标签元素 GHS Label elements, 包括预防性声明 including precautionary statements
 
象形图 Pictogram
 
危险说明 Hazard statement(s)
没有找到。 None found.
防范说明 Precautionary statement(s)
没有找到。 None found.
口服/肠胃外毒性 Oral/Parenteral Toxicity:
未定 Not determined
皮肤毒性 Dermal Toxicity:
未定 Not determined
吸入毒性 Inhalation Toxicity:
未定 Not determined
 
使用安全信息 Safety in Use Information:
类别 Category: flavoring agents
ifra纯度规格 IFRA Purity Specification: < 0.1% free allyl alcohol
推荐使用硫代己酸烯丙酯的最高使用量 Recommendation for allyl thiohexanoate usage levels up to:
 不用于香水。 not for fragrance use.
 
最大化源自调查的每日摄入量(ms di- di- eu) : 0.012(微克/ 均/天) 0.012 (μg/capita/day)
最大化源自调查的每日摄入量(ms di- di- usa) : nd(微克/ 均/天) ND (μg/capita/day)
修改后的理论增加的最大每日摄入量(mtamdi) Modified Theoretical Added Maximum Daily Intake (mTAMDI): 430(微克/ /天) 430 (μg/person/day)
Noel(没有观察到的作用水平) NOEL (No Observed Effect Level): 6.5(每日毫克/千克体重) 6.5 (mg/kg bw per day)
关注点 Threshold of Concern:540(微克/ /天) 540 (μg/person/day)
结构类 Structure Class: II
采用 Use 等级 levels for FEMA GRAS flavoring 物质 substances on 哪一个 which the FEMA 专家 Expert 面板 Panel 基于 based its its 判断 judgments that the 物质 substances are 通常 generally 公认的 recognized as safe (GRAS).
The 专家 Expert 面板 Panel also 发表 publishes 分离 separate 广泛 extensive 评论 reviews of scientific information on all FEMA GRAS flavoring 物质 substances and can be 发现 found at FEMA 味道 Flavor Ingredient 图书馆 Library
出版编号 publication number: 22
点击这里查看出版物22 Click here to view publication 22
 平均 average 通常 usual 百万分之几 ppm平均 average 最大 maximum 百万分之几 ppm
焙烤食品 baked goods: 2.5000012.50000
饮料(不含醇) beverages(nonalcoholic): 0.050000.50000
醇饮料 beverages(alcoholic): 0.250001.30000
早餐麦片 breakfast cereal: --
起司 cheese: 0.400002.00000
口香糖 chewing gum: 2.0000010.00000
调味品/调味品 condiments / relishes: 0.500003.00000
糖果烧烤 confectionery froastings: --
蛋制品 egg products: 0.250001.30000
脂肪/油 fats / oils: 0.400002.00000
鱼产品 fish products: 0.300001.50000
冷冻乳制品 frozen dairy: --
水果冰 fruit ices: --
明胶/布丁 gelatins / puddings: --
砂糖 granulated sugar: --
肉汁 gravies: 0.200001.00000
硬糖 hard candy: --
仿乳制品 imitation dairy: 0.400002.00000
速溶咖啡/茶 instant coffee / tea: --
果酱/果冻 jams / jellies: --
肉制品 meat products: 0.300001.50000
奶制品 milk products: 0.200001.00000
坚果产品 nut products: --
其他谷物 other grains: --
家禽 poultry: --
加工水果 processed fruits: --
加工蔬菜 processed vegetables: 0.200001.00000
重构蔬菜 reconstituted vegetables: --
调味料 seasonings / flavors: 0.500005.00000
休闲食品 snack foods: 0.500002.50000
软糖 soft candy: --
汤类 soups: 0.100001.00000
糖替代品 sugar substitutes: --
甜酱 sweet sauces: --
 
根据委员会法规ec EC号的食品类别。 1565/2000(ec , 2000)在fge.06(efsa 2000) in FGE.06 (EFSA, 2002a). 根据 According to the Industry the "正常 normal" use is 定义的 defined as the 平均 average of 已报告 reported 用法 用法 usages and "最大 maximum use" is 定义的 defined as the 95th 百分位 percentile of 已报告 reported 用法 用法 usages (efsa EFSA, 2002i)。 2002i).
注意 Note: 毫克/千克= 0.001 / 1000 = 0.000001 = 1/1000000 = 百万分之几 ppm
 平均 average 用法 usage mg/kg kg最大 maximum 用法 usage mg/kg kg
乳制品 Dairy products, 不包括02.0(01.0)类产品 excluding products of category 02.0 (01.0): 0.500002.00000
脂肪和油脂 Fats and oils, 和脂肪乳液(油包水型)(02.0) and fat emulsions (type water-in-oil) (02.0): 0.400002.00000
食用冰 Edible ices, 包括果子露和果汁冰糕(03.0) including sherbet and sorbet (03.0): --
加工水果(04.1) Processed fruit (04.1): 0.2000010.00000
加工蔬菜(包括蘑菇和真菌) Processed vegetables (incl. mushrooms & fungi, 根与根块茎 roots & tubers, 豆类和豆类) pulses and legumes), 和坚果种子(04.2) and nuts & seeds (04.2): 0.2000010.00000
糖果(05.0) Confectionery (05.0): 2.0000010.00000
谷物和谷物产品 Cereals and cereal products, 含税面粉根和淀粉块茎 incl. flours & starches from roots & tubers, 脉冲和豆类 pulses & legumes, 不包括面包店(06.0) excluding bakery (06.0): --
烘焙用具(07.0) Bakery wares (07.0): 2.5000012.50000
肉和肉制品 Meat and meat products, 包括家禽和野味(08.0) including poultry and game (08.0): 0.300001.50000
鱼和鱼制品 Fish and fish products, 包括软体动物 including molluscs, 甲壳类和棘皮类动物(麦克 MCE)(09.0) : 0.300001.50000
鸡蛋和蛋制品(10.0) Eggs and egg products (10.0): --
甜味剂 Sweeteners, 包括蜂蜜(11.0) including honey (11.0): --
盐 Salts, 香料 spices, 汤类 soups, 酱料 sauces, 色拉 salads, 蛋白产品 protein products, 等(12.0) etc. (12.0): 0.500005.00000
用于特定营养用途的食品(13.0) Foodstuffs intended for particular nutritional uses (13.0): --
不含醇 Non-酒鬼 alcoholic ("柔软的 soft") 饮料 beverages, 不包括乳制品(14.1) excl. dairy products (14.1): 0.050000.50000
含醇的饮料 Alcoholic beverages, 含税无醇和低醇的对口(14.2) incl. alcohol-free and low-alcoholic counterparts (14.2): 0.250001.30000
即食美味(15.0) Ready-to-eat savouries (15.0): 0.500002.50000
复合食品(例如砂锅菜) Composite foods (e.g. casseroles, 肉馅饼 meat pies, 百果馅)-无法放在01.0-15.0(16.0)类别中的食物 mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): --
 
安全参考 Safety references:
欧洲食品安全法规(efsa) European Food Safety Athority(efsa):风味使用水平;亚急性 Flavor usage levels; Subacute, 亚慢性 Subchronic, 慢性和致癌性研究;发育/ 毒性研究;遗传毒性研究... Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

欧洲食品安全局(efsa EFSA)参考 :

调味组评估91(fge.91) Flavouring Group Evaluation 91 (FGE.91): jecfa(第五十三次和第六十八次会议)评估的与脂族和脂环族单-结构相关的简单脂族和芳族硫化物和硫醇的考虑 Consideration of simple aliphatic and aromatic sulphides and thiols evaluated by JECFA (53rd and 68th meetings) structurally related to aliphatic and alicyclic mono-, di- di- , 三 tri-, and 多硫化物 poly硫化物 sulphides with or 没有 without 额外 additional 充氧 oxygenated 功能性 functional 团体 groups 已评估 evaluated by by efsa EFSA in ge FGE.08Rev1 (2009)
视图 View page or 视图 View pdf

调味品组评价的科学意见91 Scientific Opinion on Flavouring Group Evaluation 91, 版本1(fge.91rev1) Revision 1 (FGE.91Rev1): jecfa(第五十三次和第六十八次会议)评估的与脂族和脂环族单-结构相关的简单脂族和芳族硫化物和硫醇的考虑 Consideration of simple aliphatic and aromatic sulphides and thiols evaluated by JECFA (53rd and 68th meetings) structurally related to aliphatic and alicyclic mono-, di- di- , 三 tri-, and 多硫化物 poly硫化物 sulphides with or 没有 without 额外 additional 充氧 oxygenated 功能性 functional 团体 groups 已评估 evaluated by by efsa EFSA in ge FGE.08Rev3 (2011)
视图 View page or 视图 View pdf

调味品组评价的科学意见91 Scientific Opinion on Flavouring Group Evaluation 91, 修订2(fge.91rev2) Revision 2 (FGE.91Rev2): jecfa(第五十三次和第六十八次会议)评估的与脂族和脂环族单链结构相关的简单脂族和芳族硫化物和硫醇的考虑 Consideration of simple aliphatic and aromatic sulphides and thiols evaluated by the JECFA (53rd and 68th meetings) structurally related to aliphatic and alicyclic mono-, di- di- , 三 tri-, and 多硫化物 poly硫化物 sulphides with or 没有 without 额外 additional 充氧 oxygenated 功能性 functional 团体 groups 已评估 evaluated by by efsa EFSA in ge FGE.08Rev5 (2012)
视图 View page or 视图 View pdf

Epi系统 EPI System: 视图 View
EPA ACToR:毒理学资料 Toxicology Data
EPA物质注册服务(SRS) :注册表 Registry
实验室化学安全摘要 Laboratory Chemical Safety Summary :56844159
国家过敏和传染病研究所 National Institute of Allergy and Infectious Diseases:Data
s-prop-2-en-1-yl丁硫醇酯 S-prop-2-en-1-yl butanethioate
chemidplus Chemidplus:0156420698
 
参考资料 References:
 s-prop-2-en-1-yl丁硫醇酯 S-prop-2-en-1-yl butanethioate
NIST化学网络书籍 NIST Chemistry WebBook: 搜索INCHI
pubchem(cid) Pubchem (cid):56844159
pubchem(sid) Pubchem (sid):135323311
 
其他资料 Other Information:
(iupac) (IUPAC):元素的原子量2009 Atomic Weights of the Elements 2009
(iupac) (IUPAC):元素的原子量2009(pdf) Atomic Weights of the Elements 2009 (pdf)
影片 Videos:元素周期表 The Periodic Table of Videos
RBC :本网站使用的原子量 Atomic Weights use for this web site
(iupac) (IUPAC):元素周期表 Periodic Table of the Elements
食品中添加的fda物质(以前为af) FDA Substances Added to Food (formerly EAFUS):视图 View
hmdb(人类代谢组数据库) HMDB (The Human Metabolome Database):HMDB39467
食物 FooDB:FDB019071
vcf在线 VCF-Online:食品中的挥发性有机化合物 VCF Volatile Compounds in Food
化学蜘蛛 ChemSpider:视图 View
 
潜在搅拌机 Potential Blenders and 核心组件 core components note
气味 For Odor
香醋 balsamic
异 iso
propyl cinnamate
FL/FR
焦糖色 caramellic
草莓 strawberry 呋喃酮 furanone acetate
FL/FR
空灵的 ethereal
异 iso
propyl formate
FL/FR
异 iso
valeraldehyde propylene glycol acetal
FL/FR
花的 floral
para-
anisyl butyrate
FL/FR
黑 black
黑醋栗 currant 芽 bud concrete
FL/FR
alpha-
ionone
FL/FR
苯乙基 phenethyl acetate
FL/FR
罗丹酰基 rhodinyl butyrate
FL/FR
罗丹酰基 rhodinyl isobutyrate
FL/FR
玫瑰 rose butanoate
FL/FR
styralyl isobutyrate
FL/FR
fruity
allyl cyclohexyl propionate
FL/FR
butyl isobutyrate
FL/FR
异 iso
butyl isobutyrate
FL/FR
heptyl butyrate
FL/FR
neocaspirene
FL/FR
绿 green
乙基(e ethyl (E,Z)-2,4-decadienoate
FL/FR
heptanal dimethyl acetal
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
己酸己酯 hexyl hexanoateFL/FR
FL/FR
1-
penten-3-ol
FL/FR
苯氧乙基 phenoxyethyl isobutyrate
FL/FR
herbal
barosma 白桦 betulina 叶 leafoil
FL/FR
(E)-6-
methyl-3-hepten-2-one
FL/FR
viridiflorol
FL/FR
sulfurous
黑莓 黑 blackberry thiophenone
FL/FR
buchu buchu 硫醇 mercaptan
FL/FR
ethyl 2-mercaptopropionate
FL/FR
荔枝 lychee 硫醇 mercaptan acetate
FL/FR
西番莲 passiflora acetate
FL/FR
3-
thiohexanol
FL/FR
s- S-
tropical 2-thiobutyrate
FL/FR
4-
tropical oxathiane
FL/FR
tropical
cis-
galbanum oxathiane
FL/FR
hexyl 2-methyl-3-pentenoate
FL/FR
3-
nonen-4-olide
FL/FR
西番莲 passiflora edulis fruit extract
FL/FR
西番莲 passiflora edulis fruit 水 water
FL/FR
tropical 3-thiobutyrate
FL/FR
发酵母的 yeasty
2-
octen-4-one
FL/FR
用于调味 For Flavor
找不到适合这些的口味组 No flavor group found for these
异 iso
戊基 amyl 3-methyl thiopropionate
FL
黑莓 黑 blackberry thiophenone
FL/FR
s-(2 S-(2,5-
dimethyl-3-furyl) 乙烷 ethane thioate
FL
ethyl 2-(methyl dithio) propionate
FL
ethyl 2-(methyl thio) acetate
FL
ethyl 2-methyl-2-(methyl thio) propionate
FL
ethyl 硫醇 mercaptan
FL
methyl 2-(methyl thio) acetate
FL
(E)-6-
methyl-3-hepten-2-one
FL/FR
neocaspirene
FL/FR
3-
nonen-4-olide
FL/FR
s- S-
prenyl thioisobutyrate
FL
s- S-
prenyl thioisovalerate
FL
山梨糖基 sorby byl propionate
FL
styralyl isobutyrate
FL/FR
s- S-
tropical 2-thiobutyrate
FL/FR
viridiflorol
FL/FR
3-
mercapto-3-methyl-1-butyl acetate
FL
烦 的 anisic
烦 的 anisic
para-
anisyl butyrate
FL/FR
香醋 balsamic
异 iso
propyl cinnamate
FL/FR
焦糖色 caramellic
草莓 strawberry 呋喃酮 furanone acetate
FL/FR
俗气的 cheesy
methyl ketones
FL
柑橘类 citrus
3-
mercaptoheptyl acetate
FL
奶油状 creamy
三醋精 triacetin
FL
花的 floral
alpha-
ionone
FL/FR
罗丹酰基 rhodinyl butyrate
FL/FR
罗丹酰基 rhodinyl isobutyrate
FL/FR
fruity
allyl cyclohexyl propionate
FL/FR
butyl isobutyrate
FL/FR
异 iso
butyl isobutyrate
FL/FR
黑 black
黑醋栗 currant 芽 bud concrete
FL/FR
hexyl 2-methyl-3-pentenoate
FL/FR
己酸己酯 hexyl hexanoateFL/FR
FL/FR
3-
mercapto己酸己酯 hexyl hexanoateFL/FR
FL
甲硫基 methionyl butyrate
FL
热情 passion fruit distillates
FL
异 iso
propyl formate
FL/FR
玫瑰 rose butanoate
FL/FR
4-
tropical oxathiane
FL/FR
异 iso
valeraldehyde propylene glycol acetal
FL/FR
绿 green
乙基(e ethyl (E,Z)-2,4-decadienoate
FL/FR
cis-
galbanum oxathiane
FL/FR
heptanal dimethyl acetal
FL/FR
heptyl butyrate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
1-
penten-3-ol
FL/FR
苯氧乙基 phenoxyethyl isobutyrate
FL/FR
herbal
barosma 白桦 betulina 叶 leafoil
FL/FR
buchu buchuoil fractions
FL
蜜糖 honey
苯乙基 phenethyl acetate
FL/FR
多汁的 juicy
荔枝 lychee 硫醇 mercaptan acetate
FL/FR
洋葱 onion
ethyl 2-mercaptopropionate
FL/FR
sulfurous
buchu buchu 硫醇 mercaptan
FL/FR
s- S-
ethyl thioacetate
FL
methyl 2-(methyl thio) butyrate
FL
methyl 硫代甲基 thiomethyl butyrate
FL
3-
thiohexanol
FL/FR
tropical 3-thiobutyrate
FL/FR
tropical
anacardium occidentale fruit puree
FL
3-
mercaptohexyl butyrate
FL
西番莲 passiflora acetate
FL/FR
西番莲 passiflora edulis fruit extract
FL/FR
西番莲 passiflora edulis fruit 水 water
FL/FR
蔬菜 vegetable
2-
octen-4-one
FL/FR
 
潜在用途 Potential Uses:
FLfruit tropical fruit
FL大蒜 garlic
FL洋葱 onion
 
存在(自然 Occurrence (nature, food, 其他) other):note
 大蒜炒大蒜 garlic fried garlic
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同义词 Synonyms:
 allyl butane thioate
s- S-allyl hexanethioate
2-(allyl 硫烷基 sulfanyl)-1-heptene 水合物 hydrate
 hexane 硫的 thioic acid s- S-2-propenyl 酯 估 ester
 己硫基 hexane硫的 thioic acid, s-2-丙烯-1-基酯 S-2-propen-1-yl ester
s- S-prop-2-en-1-yl butanethioate
 

文章 Articles:

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笔记 Notes:
香气成分。炒大蒜 Aroma constit. of fried garlic
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