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Substance Name: Ethyl cyclohexylacetate
RN: 5452-75-5
UNII: V36O028G9R
InChIKey: ZBDAMDWKXGTKBT-UHFFFAOYSA-N

Molecular Formula

  • C10-H18-O2

Molecular Weight

  • 170.25
 
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Names and Synonyms

Name of Substance

  • Ethyl cyclohexylacetate

Synonyms

  • 4-09-00-00038 (Beilstein Handbook Reference)
  • AI3-14042
  • BRN 2043392
  • EINECS 226-695-2
  • Ethyl cyclohexaneacetate
  • Ethyl cyclohexylacetate
  • NSC 18985
  • UNII-V36O028G9R

Systematic Names

  • Cyclohexaneacetic acid, ethyl ester
  • Ethyl cyclohexylacetate

Registry Numbers

CAS Registry Number

  • 5452-75-5

FDA UNII

  • V36O028G9R

System Generated Number

  • 0005452755

Structure Descriptors

InChI

1S/C10H18O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h9H,2-8H2,1H3

InChIKey

ZBDAMDWKXGTKBT-UHFFFAOYSA-N

Smiles

C1(CC(OCC)=O)CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02543,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 211 deg C   EXP
log P (octanol-water) 3.620 (none)   EST
Atmospheric OH Rate Constant 1.27E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.