Propyl hexanoate 己酸丙酯
CAS 626-77-7 MFCD00053803
化学结构图
SMILES: CCCCCC(=O)OCCC
化学属性
| Mol. Formula | C9H18O2 |
|---|---|
| Mol. Weight | 158.24 |
| Refractive index | 1.4100 to 1.4140 |
| Boiling Point | 187 °C at 760 mmHg |
| Density | 0.876 |
| Melting Point | -69 °C |
| Flash Point | 52°C(lit.) |
| TSCA | Yes |
| Appearance | 无色至淡黄色液体。呈菠萝和黑莓香气，有醚香。熔点-69℃，沸点187℃。溶于乙醇，不溶于水。 |
别名和识别编码
| Chemical Name | n-Propyl Hexanoate |
|---|---|
| Synonym | Propyl hexanoate {LY} Propyl hexanoate {} {LY} Propyl hexanoate {} {} {LY} Propyl hexanoate {} {} {} {LY} Propyl hexanoate {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Propyl hexanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} |
| CAS Number | 626-77-7 |
| MDL Number | MFCD00053803 |
| PubChem Substance ID | 12293 |
| EC Number | 210-963-0 |
| Reaxys-RN | 1752238 |
| Chemical Name Translation | 己酸丙酯 |
| LabNetwork Molecule ID | LN00224795 |
| InChI | InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3 |
| Canonical SMILES | CCCCCC(OCCC)=O |
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信息真实价格透明
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现货库存
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分类
- {Chemicalbook} 食品添加剂: 食用香料（增香剂）: 天然等同香料和人造香
- {SNA} Alphabetical Listings, Flav
- {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, N-P,
- {SNA} Alphabetical Listings, Certified Natural Produ
- {SNA} Alphabetical Listings, Certified Natural Products, Flavors and Fragrances, Halal Certified Products, Kosher Certified Products, O-P, O-Z
- {SNA} Alphabetical Listings, Certified Food Grade Products, Certified Natural Products, Flavors and Fragrances, Follows IFRA Guidelines, Halal Certified Products, Kosher Certified Products, N-P, O - Z, O-P, O-Z
- {uni_hamburg} no charge; ester; 1fragment
相关文献及参考
- Short: EINECS Title: EINECS (Europ
- Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
- Short: IV/18B Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/18B Year: 2001 Keyword: organic compounds; viscosity; liquids; mixtures Internet Resource: DOI:10.1007/b68240 RefComment: VII, 409 pages.
- Short: IV/20B Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R. Source: Landolt-Börnstein, New Series Volume: IV/20B Year: 2000 Keyword: organic compounds; vapor pressure ISBN: 3-540-64968-9 ISBN: 978-3-540-64968-7 Internet Resource: DOI:10.1007/b71424 RefComment: VII, 320 pages.
- Short: IV/8H Title: Densities of Esters and Ethers Author: Frenkel, M.; Hong, X.; Wilhoit, R.C.; Hall, K.R. Editor: Hall, K.R.; Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8H Year: 2001 Keyword: organic compounds; density; liquids ISBN: 3-540-41035-X ISBN: 978-3-540-41035-5 Internet Resource: DOI:10.1007/b76770 RefComment: XI, 484 pages, with CD-ROM, Hardcover
安全信息
GHS Symbol
- H226 Flammable liquid and vapour 易燃液体和蒸气
- R10 Flammable 易燃
- S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P233 Keep container tightly closed. ?保持容器密闭。
- P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
- P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
- P242 Use only non-sparking tools. 只能使用无火花工具。
- P243 Take precautionary measures against static discharge. 采取预防措施，防止静电放电。
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- P303+P361+P353
- P370+P378
- P403+P235
- P501 Dispose of contents/container to..… 处理内容物/容器.....
其他信息
- 己酸丙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 B25215 己酸正丙酯, 97% n-Propyl hexanoate, 98% 500g 6048元 2010/05/25 B25215 己酸正丙酯, 97% n-Propyl hexanoate, 98% 25g 435元 2010/05/25 B25215 己酸正丙酯, 97% n-Propyl hexanoate, 98% 100g 1526元
- MOL 文件:626-77-7.mol
- FEMA:2949
- Sigma Aldrich:626-77-7(sigmaaldrich)
- 用途一:GB 2760一1996规定为允许使用的食用香料。主要用以配制菠萝、罗甘莓等水果型香精。
- 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量（g/kg） 最大允许残留量（g/kg） 己酸丙酯 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
- Alfa Aesar:己酸正丙酯,97% n-Propyl hexanoate, 98%(626-77-7)
- 方法一:由己酸和丙醇在对甲苯磺酸存在下于苯介质中酯化而成。
- MSDS 信息:Caproic acid propyl ester(626-77-7).msds
- 参考质量标准:FAO/WHO，1997 含量(GT-10-4) ≥95.0% 折射率(n D 20 ) 1.409～1.413 相对密度(d 25 25 ) 0.865~0.871
- 上游原料:对甲苯磺酸 --> 己酸
- 毒性:GRAS(FEMA)。
