Pentyl 3-Oxobutanoate 乙酰乙酸-n-戊酯

CAS 6624-84-6 MFCD00059433

化学结构图

6624-84-6
SMILES: CCCCCOC(=O)CC(C)=O

化学属性

Mol. FormulaC9H16O3
Mol. Weight172.22
Refractive index1.4260 to 1.4320
Boiling Point222 °C at 760 mmHg

别名和识别编码

Chemical NamePentyl 3-Oxobutanoate
Synonym Pentyl 3-oxobutanoate {LY} Pentyl 3-oxobutanoate {} {LY} Pentyl 3-oxobutanoate {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobutanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Pentyl 3-oxobut
MDL NumberMFCD00059433
CAS Number6624-84-6
Reaxys-RN1763981
PubChem Substance ID87562336
Chemical Name Translation乙酰乙酸-n-戊酯
InChIKeyIDZAUPYMMSSVHP-UHFFFAOYSA-N
LabNetwork Molecule IDLN01739961
Canonical SMILESCCCCCOC(=O)CC(=O)C
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分类

  • {uni_hamburg} no charge; ester; ketone; 1fragment

相关文献及参考

  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

Signal word
Hazard statements
  • H227 Combustible liquid 可燃液体
Precautionary statements
  • 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。
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P332+P313
  • P370+P378
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+
GHS Symbol
Storage condition

系列性分类

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