(e)-3-己烯-1-基己酸酯 (E)-3-hexen-1-yl hexanoate
反己烯酸三-3-己酯 trans-3-hexenyl hexanoate

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CAS号 CAS Number: 56922-82-8Picture of molecule3D/INCHI
ECHA EINECS - REACH 预注册 Pre-Reg:260-444-8
FDA UNII:4A4GL78VUN
nikkaji网站 Nikkaji Web:J118.170J
MDL :mfcd00792505 MFCD00792505
XlogP3-AA:3.80(est) 3.80 (est)
分子量 Molecular Weight:198.30574000
式 Formula:c12 h22 o2 C12 H22 O2
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:flavor and fragrance 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
Flavis号码 FLAVIS Number:09.855(旧) 09.855 (Old)
dg sante食品调味料 DG SANTE Food Flavourings:09.855(3e)-己酸己酯 09.855 (3E)-hexenyl hexanoate
 
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:0.88300 to 0.88900 @ 25.00 °C.
磅每加仑-(est)。 Pounds per Gallon - (est).: 7.347 to 7.397
折光率 Refractive Index:1.42800 to 1.43400 @ 20.00 °C.
沸点 Boiling Point: 253.00 °C. @ 760.00 mm 汞 Hg
蒸汽压力 Vapor Pressure:0.016000 毫米汞柱 mm汞 Hg @ 25.00 °C. (est)
闪点 Flash Point: 188.00 °F. tcc TCC ( 86.67 °C. )
logp(o / w) logP (o/w): 4.438(est) 4.438 (est)
溶于 Soluble in:
 alcohol
 水 water, 5.496 mg / l @ 25°c(est) 5.496 mg/L @ 25 °C (est)
不溶于 Insoluble in:
 水 water
类似物品 Similar Items:note
己酸烯丙酯 allyl hexanoate
硫代己酸烯丙酯 allyl thiohexanoate
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)-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 hexanoate
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:
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:
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: flavor and fragrance agents
 
最大化源自调查的每日摄入量(msdi-eu) Maximised Survey-derived Daily Intakes (MSDI-EU): 0.21(微克/ 均/天) 0.21 (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): 3900(微克/ /天) 3900 (μg/person/day)
关注点 Threshold of Concern:1800(微克/ /天) 1800 (μg/person/day)
结构类 Structure Class: I
 
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): 7.0000035.00000
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): 5.0000025.00000
食用冰 Edible ices, 包括果子露和果汁冰糕(03.0) including sherbet and sorbet (03.0): 10.0000050.00000
加工水果(04.1) Processed fruit (04.1): 7.0000035.00000
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): 10.0000050.00000
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): 5.0000025.00000
烘焙用具(07.0) Bakery wares (07.0): 10.0000050.00000
肉和肉制品 Meat and meat products, 包括家禽和野味(08.0) including poultry and game (08.0): 2.0000010.00000
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) : 2.0000010.00000
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): 5.0000025.00000
用于特定营养用途的食品(13.0) Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
不含醇 Non-alcoholic ("柔软的 soft") 饮料 beverages, 不包括乳制品(14.1) excl. dairy products (14.1): 5.0000025.00000
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): 10.0000050.00000
即食美味(15.0) Ready-to-eat savouries (15.0): 20.00000100.00000
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): 5.0000025.00000
 
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 :

食品添加剂科学小组的意见 Opinion of the Scientific Panel on food additives, 调味料 flavourings, 与调味剂组评估6有关的与食品(afc AFC)接触的加工助剂和材料(fge.06) : 直链和支链脂族不饱和伯醇 Straight- and branched-chain aliphatic unsaturated primary alcohols, 醛类 aldehydes, 羧酸 carboxylic acids, and esters from chemical 团体 groups 1 and 4
视图 View page or 视图 View pdf

调味组评估6 Flavouring Group Evaluation 6, 版本1(fge.06rev1)-食品添加剂科学小组的意见 Revision 1 (FGE.06Rev1) - Opinion of the Scientific Panel on Food Additives, 调味料 flavourings, 处理中 Processing 艾滋病 Aids and 材料 Materials in contact with Food (afc AFC)
视图 View page or 视图 View pdf

调味基评估62(fge.62)考虑线性和支链脂族不饱和 Flavouring Group Evaluation 62 (FGE.62) Consideration of linear and branched-chain aliphatic unsaturated, 非共轭醇 unconjugated alcohols, 醛类 aldehydes, acids, 由西班牙 引入南美。现在在所有这些地方以及西印度群岛和非洲都有商业化种植。它自古以来就广为 知 and related esters evaluated by JECFA (61st meeting) structurally related to esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, efsa EFSA在fge.05(2005)中评估的直链和支链和直链不饱和羧酸,以及直链和支链的脂肪族不饱和伯醇 , 醛类 aldehydes, 羧酸 carboxylic acids, and esters 已评估 evaluated by by efsa EFSA in ge FGE.06 (2004) (佣金 Commission 规 Regulation (ec EC) No 1565/2000 of 18 July 2000)
视图 View page or 视图 View pdf

调味品组评价的科学见解06 Scientific Opinion on Flavouring Group Evaluation 06, 版本2(fge.06rev2) Revision 2 (FGE.06Rev2): 直链和支链脂族不饱和伯醇 Straight- and branched-chain aliphatic unsaturated primary alcohols, 醛类 aldehydes, 羧酸 carboxylic acids, and esters from chemical 团体 groups 1 and 4
视图 View page or 视图 View pdf

调味品组评价的科学见解06 Scientific Opinion on Flavouring Group Evaluation 06, 版本3(fge.06rev3) Revision 3 (FGE.06Rev3): 直链和支链脂族不饱和伯醇 Straight- and branched-chain aliphatic unsaturated primary alcohols, 醛类 aldehydes, 羧酸 carboxylic acids, and esters from chemical 团体 groups 1 and 4
视图 View page or 视图 View pdf

调味品组评价的科学见解06 Scientific Opinion on Flavouring Group Evaluation 06, 修订版4(fge.06rev4) Revision 4 (FGE.06Rev4): 直链和支链脂族不饱和伯醇 Straight- and branched-chain aliphatic unsaturated primary alcohols, 醛类 aldehydes, 来自化学组的羧酸和酯1 carboxylic acids and esters from chemical groups 1, 3 and 4
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 :5352975
国家过敏和传染病研究所 National Institute of Allergy and Infectious Diseases:Data
[(e)-己-3-烯基]己酸酯 [(E)-hex-3-enyl] hexanoate
chemidplus Chemidplus:0056922828
 
参考资料 References:
 [(e)-己-3-烯基]己酸酯 [(E)-hex-3-enyl] hexanoate
NIST化学网络书籍 NIST Chemistry WebBook: 搜索INCHI
加拿大国内分公司。清单 Canada Domestic Sub. List:56922-82-8
pubchem(cid) Pubchem (cid):5352975
pubchem(sid) Pubchem (sid):135048713
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
hmdb(人类代谢组数据库) HMDB (The Human Metabolome Database):搜索 Search
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
没找到 None found
 
潜在用途 Potential Uses:
没找到 None found
 
存在(自然 Occurrence (nature, food, 其他) other):note
  feyoa-最高0.01 mg / kg kg
搜索 Search pmc PMC Picture
  番石榴果实-最高0.01 mg / kg kg
搜索 Search Trop Picture
 蜂蜜-0.8毫克/千克 honey - 0.8 mg/kg
搜索 Search pmc PMC Picture
  西番莲种类-最高0.07 mg / kg kg
搜索 Search pmc PMC Picture
  草莓野草莓果实-最高0.6 mg / kg kg
搜索 Search Trop Picture
 
同义词 Synonyms:
(3E)-hex-3-en-1-yl hexanoate
(E)-hex-3-enyl hexanoate
trans-hex-3-enyl hexanoate
[(E)-hex-3-enyl] hexanoate
 hexanoic acid (E)-hex-3-enyl ester
(E)-hexanoic acid 3-己烯基酯 3-hexenyl ester
trans-hexanoic acid 3-己烯基酯 3-hexenyl ester
 hexanoic acid, (3E)-3-hexen-1-yl ester
 hexanoic acid, 3-己烯基酯 3-hexenyl ester, (E)-
(E)-3-hexen-1-ol, hexanoate
trans-3-hexen-1-yl hexanoate
(3E)-hexenyl hexanoate
(E)-3-hexenyl hexanoate
trans-3-hexenyl hexanoate
 

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