(1S,2S,5R)-2-Isopropyl-5-Methylcyclohexyl Acetate (1S,2S,5R)-2-异丙基-5-甲基环己基乙酸酯

CAS 2552-91-2 MFCD00062978

化学结构图

2552-91-2
SMILES: CC(=O)O[C@H]1C[C@H](C)CC[C@H]1C(C)C

化学属性

Mol. FormulaC12H22O2
Mol. Weight198.30
Boiling Point81 °C/3 mmHg(lit.)
Density0.912 g/mL at 25 °C(lit.)
Melting Point36-38 °C(lit.)

别名和识别编码

Chemical Name(1S,2S,5R)-2-Isopropyl-5-Methylcyclohexyl Acetate
Synonym acetic acid (1S)-neomenthyl ester (+)-neomenthyl acetate (+)-(1S,2S,5R)-新薄荷基乙酸酯
PubChem Substance ID75699
EC Number219-856-3
Beilstein Registry Number2208504
MDL NumberMFCD00062978
InChIKeyXHXUANMFYXWVNG-USWWRNFRSA-N
InChIInChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12+/m1/s1
Chemical Name Translation(1S,2S,5R)-2-异丙基-5-甲基环己基乙酸酯
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分类

  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; ester; chiral; 1fragment
  • {SA} Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Esters, Organic Building Blocks

相关文献及参考

  • 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: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H228 Flammable solid 易燃固体
Personal Protective Equipment Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Precautionary statements
  • 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。
Signal word Danger

系列性分类

  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Organic Building Blocks - Chiral Building Blocks
  5. Esters - Organic Building Blocks

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