庚硫醇 heptyl mercaptan
heptane-1-thiol

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    08-07550庚烷-1-硫醇 08-07550 HEPTANE-1-THIOL
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    sv2091 1-庚硫醇f& f SV2091 1-Heptanethiol F&F
    th0650 1-庚硫醇 TH0650 1-Heptanethiol
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    w425900 1-庚硫醇 W425900 1-Heptanethiol, 98%
    SDS
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    h0029 1-庚硫醇> 96.0%(gc) H0029 1-Heptanethiol >96.0%(GC)
Name:heptane-1-thiol
CAS号 CAS Number: 1639-09-4Picture of molecule3D/INCHI
echa ECHA einecs EINECS - REACH 预注册 Pre-Reg:216-678-8
FDA UNII:380ZE61GR2
nikkaji网站 Nikkaji Web:J21.665H
贝尔斯坦数 Beilstein Number:1731687
MDL :mfcd00004911 MFCD00004911
代号 CoE Number:11485
XlogP3:3.90(est) 3.90 (est)
分子量 Molecular Weight:132.26952000
式 Formula:c7 h16 s C7 H16 S
核磁共振预测器 NMR Predictor:预测(适用于Chrome或Firefox) Predict (works with chrome or firefox)
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
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NCBI:搜索 Search
jecfa食品调味料 JECFA Food Flavoring:1663庚烷-1-硫醇 1663 heptane-1-thiol
Flavis号码 FLAVIS Number:12.130(旧) 12.130 (Old)
dg sante食品调味料 DG SANTE Food Flavourings:12.130庚烷-1-硫醇 12.130 heptane-1-thiol
fema号 FEMA Number:4259 heptane-1-thiol
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):1639-09-4 ; 庚烷-1-硫醇 HEPTANE-1-THIOL
 
物理性质 Physical Properties:
出现 Appearance:无色透明液体(est) colorless clear liquid (est)
化验 Assay: 95.00至100.00 95.00 to 100.00
食品化学品法典列表 Food Chemicals Codex Listed: No
比重 Specific Gravity:0.84000 to 0.84600 @ 25.00 °C.
磅每加仑-(est)。 Pounds per Gallon - (est).: 6.990 to 7.040
折光率 Refractive Index:1.49700 to 1.50300 @ 20.00 °C.
沸点 Boiling Point: 175.00 °C. @ 765.00 mm 汞 Hg
沸点 Boiling Point: 57.00 to 58.00 °C. @ 10.00 mm 汞 Hg
蒸汽压力 Vapor Pressure:1.467000 毫米汞柱 mm汞 Hg @ 25.00 °C. (est)
闪点 Flash Point: 115.00 °F. tcc TCC ( 46.11 °C. )
logp(o / w) logP (o/w): 3.989(est) 3.989 (est)
溶于 Soluble in:
 alcohol
 水 water, 59.6 mg/L @ 25 &deg °C (est)
 水 water, 9.26 mg / l @ 20°C(实验值) 9.26 mg/L @ 20 °C (exp)
不溶于 Insoluble in:
 水 water
类似物品 Similar Items:note
烯丙基硫醇 allyl mercaptan
戊基硫醇 amyl mercaptan
异戊硫醇 isoamyl mercaptan
仲戊基硫醇 sec-amyl mercaptan
叔戊基硫醇 tert-amyl mercaptan
苄硫醇 benzyl mercaptanFL
布楚硫醇 buchu mercaptan
丁基硫醇 butyl mercaptan
异丁基硫醇 isobutyl mercaptan
叔丁基硫醇 tert-butyl mercaptan
十六烷基硫醇 cetyl mercaptan
环己基硫醇 cyclohexyl mercaptan
环戊硫醇 cyclopentyl mercaptan
癸硫醇 decyl mercaptan
十二烷基硫醇 dodecyl mercaptan
2-乙基己基硫醇 2-ethyl hexyl mercaptan
乙基硫醇 ethyl mercaptan
乙烯硫醇 ethylene mercaptan
糠基硫醇 furfuryl mercaptan
葡萄柚硫醇 grapefruit mercaptanFL/FR
己硫醇 hexyl mercaptan
甲硫醇 methyl mercaptan
2-萘硫醇 2-naphthyl mercaptan
壬基硫醇 nonyl mercaptan
辛基硫醇 octyl mercaptan
桃硫醇 peach mercaptan
1-苯乙基硫醇 1-phenethyl mercaptan
2-苯乙基硫醇 2-phenethyl mercaptan
苯硫醇 phenyl mercaptan
异戊烯硫醇 prenyl mercaptan
丙基硫醇 propyl mercaptan
异丙硫醇 isopropyl mercaptan
2-噻吩硫醇 2-thienyl mercaptan
3-噻吩硫醇 3-thienyl mercaptan
十三烷基硫醇 tridecyl mercaptan
十一烷基硫醇 undecyl mercaptan
 
感官特性 Organoleptic Properties:
气味类型 Odor Type: sulfurous
气味强度 Odor Strength:高 high ,
建议在0.10%或更少的溶液中闻到 recommend smelling in a 0.10 % solution or less
sulfurous onion
气味描述 Odor Description:at 0.10 % in propylene glycol. 含硫洋葱 sulfurous onion
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:
BOC Sciences
仅供实验/研究使用。 For experimental / research use only.
正庚硫醇 N-Heptanthiol
Emd 微孔 Millipore
仅供实验/研究使用。 For experimental / research use only.
1-Heptanethiol
Endeavour Specialty Chemicals
1-Heptanethiol
特种化工产品组 Speciality Chemical Product Groups
M&U International
1-庚硫醇 1-HEPTANETHIOL, 犹太洁食 Kosher
Penta International
庚烷-1-硫醇 HEPTANE-1-THIOL
Robinson Brothers
1-庚硫醇f& f 1-Heptanethiol F&F
https: //www.robinsonbrothers.uk/化学能力 chemistry-competences
Robinson Brothers
1-Heptanethiol
圣克鲁斯生物技术 Santa Cruz Biotechnology
仅供实验/研究使用。 For experimental / research use only.
1-Heptanethiol
Sigma-Aldrich
1-Heptanethiol, 98%
认证食品级产品 Certified Food Grade Products
TCI AMERICA
仅供实验/研究使用。 For experimental / research use only.
1-庚硫醇> 96.0%(gc) 1-Heptanethiol >96.0%(GC)
 
安全信息 Safety Information:
首选SDS Preferred SDS: 视图 View
欧洲信息 European information :
最重要的危害 Most important hazard(s):
xi-刺激性 Xi - Irritant
R 10 - 易燃的 Flammable.
R 38 - 烦 的 Irritating to skin 皮.
S 02 - 保持 Keep out of the 达到 reach of 孩子们 children.
S 24/25 - 避免 Avoid contact with skin 皮 and 眼睛 眼睛 eyes.
S 26 - In 案件 case of contact with 眼睛 眼睛 eyes, 冲洗 rinse 立即 immediately with 充裕 plenty of 水 water and 寻求 seek 医疗 medical advice.
S 36/37/39 - 穿 Wear 适当 suitable 服装 clothing, 手套和眼睛/面部防护。 gloves and eye/face protection.
 
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:
腹腔内小鼠 intraperitoneal-mouse LD50 200 mg/kg kg
国民 National 技术 Technical Information 服务 Service. 卷 Vol. AD277-689

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
推荐的庚基硫醇使用水平 Recommendation for heptyl mercaptan 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) : 0.037(微克/ 均/天) 0.037 (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): 78(微克/ /天) 78 (μg/person/day)
Noel(没有观察到的作用水平) NOEL (No Observed Effect Level): 0.56(每天mg / kg kg体重)
关注点 Threshold of Concern:1800(微克/ /天) 1800 (μg/person/day)
结构类 Structure Class: I
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 也 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: 23
点击这里查看出版物23 Click here to view publication 23
 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: 0.200001.00000
饮料(不含醇) beverages(nonalcoholic): --
醇饮料 beverages(alcoholic): --
早餐麦片 breakfast cereal: 0.100000.50000
起司 cheese: 0.200001.00000
口香糖 chewing gum: --
调味品/调味品 condiments / relishes: 0.100000.50000
糖果烧烤 confectionery froastings: 0.200001.00000
蛋制品 egg products: --
脂肪/油 fats / oils: 0.100000.50000
鱼产品 fish products: 0.100000.20000
冷冻乳制品 frozen dairy: 0.200001.00000
水果冰 fruit ices: 0.200001.00000
明胶/布丁 gelatins / puddings: 0.200001.00000
砂糖 granulated sugar: --
肉汁 gravies: 0.100000.50000
硬糖 hard candy: 0.200001.00000
仿乳制品 imitation dairy: 0.200001.00000
速溶咖啡/茶 instant coffee / tea: --
果酱/果冻 jams / jellies: --
肉制品 meat products: 0.100000.20000
奶制品 milk products: 0.200001.00000
坚果产品 nut products: --
其他谷物 other grains: 0.100000.50000
家禽 poultry: 0.100000.20000
加工水果 processed fruits: 0.200001.00000
加工蔬菜 processed vegetables: --
重构蔬菜 reconstituted vegetables: --
调味料 seasonings / flavors: 0.100000.50000
休闲食品 snack foods: 0.400002.00000
软糖 soft candy: 0.200001.00000
汤类 soups: 0.100000.50000
糖替代品 sugar substitutes: --
甜酱 sweet sauces: 0.100000.50000
 
根据委员会法规EC号的食品类别。 1565/2000(ec Food categories according to Commission Regulation EC No. 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): 0.200001.00000
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): 0.100000.50000
食用冰 Edible ices, 包括果子露和果汁冰糕(03.0) including sherbet and sorbet (03.0): 0.200001.00000
加工水果(04.1) Processed fruit (04.1): 0.200001.00000
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): --
糖果(05.0) Confectionery (05.0): 0.200001.00000
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): 0.100000.50000
烘焙用具(07.0) Bakery wares (07.0): 0.200001.00000
肉和肉制品 Meat and meat products, 包括家禽和野味(08.0) including poultry and game (08.0): 0.100000.20000
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) : 0.100000.20000
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): 0.100000.50000
用于特定营养用途的食品(13.0) Foodstuffs intended for particular nutritional uses (13.0): 0.200001.00000
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): 0.100000.50000
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): 0.200001.00000
即食美味(15.0) Ready-to-eat savouries (15.0): 0.400002.00000
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): 0.100000.50000
 
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 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 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 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
尼什国际化学品安全卡 NIOSH International Chemical Safety Cards:search
尼什袖珍指南 NIOSH Pocket Guide:search
EPA物质注册服务(tsca TSCA) :1639-09-4
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 :15422
国家过敏和传染病研究所 National Institute of Allergy and Infectious Diseases:Data
明智的 WISER:联合国3336 UN 3336
德国wgk WGK Germany:3
heptane-1-thiol
chemidplus Chemidplus:0001639094
epa / noaa客串 EPA/NOAA CAMEO:有害物质 hazardous materials
技术 RTECS:1639-09-4
 
参考资料 References:
 heptane-1-thiol
NIST化学网络书籍 NIST Chemistry WebBook: 搜索INCHI
pubchem(cid) Pubchem (cid):15422
pubchem(sid) Pubchem (sid):134980192
信息基 Pherobase:视图 View
 
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):HMDB32304
食物 FooDB:FDB009548
出口关税代码 Export Tariff Code:2930.90.9190
雾度图 Haz-Map:视图 View
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 core 组件 components note
气味 For Odor
柑橘类 citrus
葡萄柚硫醇 grapefruit mercaptanFL/FR
FL/FR
sulfurous
dimethyl sulfide
FL/FR
2-
methyl 5-(methyl thio) furan
FL/FR
3-(
methyl thio) hexanol
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
2,3,5-
trithiahexane
FL
胶质的 alliaceous
胶质的 alliaceous
苄硫醇 benzyl mercaptanFL
FL
1,3-
butane dithiol
FL
3-
mercapto-2-methyl pentanol
FL
柑橘类 citrus
葡萄柚硫醇 grapefruit mercaptanFL/FR
FL/FR
多肉的 meaty
bis(2-
methyl-3-furyl) disulfide
FL
金属的 metallic
3-(
methyl thio) hexanol
FL/FR
发霉的 musty
2-
methyl 5-(methyl thio) furan
FL/FR
onion
methionol
FL
methyl propyl disulfide
FL
methyl propyl trisulfide
FL
sulfurous
allyl sulfide
FL
dimethyl sulfide
FL/FR
3-
mercapto-2-methyl pentanal
FL
 
潜在用途 Potential Uses:
FLonion
 
存在(自然 Occurrence (nature, food, 其他) other):note
 天然产物 found in nature
 
同义词 Synonyms:
1-heptane thiol
 heptane-1-thiol
 heptanethiol
1-heptanethiol
N-heptanethiol
N-heptanthiol
N-庚硫醇 heptyl mercaptan
 heptyl thiol
N-heptylmercaptan
 庚硫醇 heptylthiol
 mercaptan C7
1-mercaptoheptane
 

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笔记 Notes:
用作食品添加剂[eafus] Used as a food additive [EAFUS]
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