Butyl octanoate 辛酸正丁酯
CAS 589-75-3 MFCD00048918
化学结构图
SMILES: CCCCCCCC(=O)OCCCC
化学属性
| Mol. Formula | C12H24O2 |
|---|---|
| Mol. Weight | 200.32 |
| Density | 0.86 g/mL at 25 °C(lit.) |
| Boiling Point | 245 °C at 760 mmHg |
| Flash Point | 124°C(lit.) |
| Refractive index | 1.4230 to 1.4260 |
| Melting Point | -42.9 °C |
别名和识别编码
| Chemical Name | Butyl Octanoate |
|---|---|
| Synonym | Butyl octanoate {LY} Butyl octanoate butyl caproate butyl caprylate {} {LY} Butyl octanoate {} {} {LY} Butyl octanoate {} {} {} {LY} Butyl octanoate {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Butyl octanoate {} {} {} {} {} {} {} { |
| MDL Number | MFCD00048918 |
| CAS Number | 589-75-3 |
| EC Number | 209-659-0 |
| Chemical Name Translation | 辛酸正丁酯 |
| Reaxys-RN | 1762103 |
| Beilstein Registry Number | 2(4)987 |
| PubChem Substance ID | 11517 |
| InChIKey | PSXNDMJWRZYVTM-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN01743486 |
| InChI | InChI=1S/C12H24O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h3-11H2,1-2H3 |
| Canonical SMILES | CCCCCCCC(=O)OCCCC |
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分类
- {uni_hamburg} no charge; ester; 1fragment
- {SNA} Building Blocks, C12 to C63, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
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
- S36 Wear suitable protective clothing 穿戴适当的防护服；
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
其他信息
- TCI Shanghai:辛酸丁酯 Butyl n-Octanoate,>;99.0%(GC)(589-75-3)
- 辛酸正丁酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 O0029 正辛酸丁酯 Butyl n-Octanoate 500ML 1590元 2011/04/16 O0029 正辛酸丁酯 Butyl n-Octanoate 25ML 252元
- 辛酸正丁酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 O0029 正辛酸丁酯 Butyl n-Octanoate 500ML 2020元 2014/06/02 O0029 正辛酸丁酯 Butyl n-Octanoate 25ML 319元
- MOL 文件:589-75-3.mol
- 图谱信息:辛酸正丁酯(589-75-3)核磁图( 1 HNMR) 辛酸正丁酯(589-75-3)Raman光谱 辛酸正丁酯(589-75-3)红外图谱(IR1) 辛酸正丁酯(589-75-3)质谱(MS) 辛酸正丁酯(589-75-3)核磁图( 13 CNMR) 辛酸正丁酯(589-75-3)红外图谱(IR2)
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