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Substance Name: 4-tert-Butylcyclohexyl acetate
RN: 32210-23-4
UNII: 21EUM2B8UC
InChIKey: MBZRJSQZCBXRGK-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H22-O2

Molecular Weight

  • 198.304
 
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Names and Synonyms

Name of Substance

  • 4-tert-Butylcyclohexyl acetate

Synonyms

  • 4-t-Butylcyclohexyl acetate
  • 4-tert-Butyl cyclohexyl acetate
  • 4-tert-Butylcyclohexanol acetate
  • 4-tert-Butylcyclohexyl acetate
  • 4-tert-Butylhexahydrophenyl acetate
  • Acetic acid, (4-tert-butylcyclohexyl) ester
  • AI3-36523
  • Cyclohexanol, 4-tert-butyl-, acetate
  • EC 250-954-9
  • EINECS 250-954-9
  • NSC 163103
  • p-tert-Butyl cyclohexyl acetate
  • p-tert-Butylcyclohexyl acetate
  • UNII-21EUM2B8UC
  • Vertenex

Systematic Names

  • 4-tert-Butylcyclohexyl acetate
  • Acetic acid, (4-tert-butylcyclohexyl) ester
  • Cyclohexanol, 4-(1,1-dimethylethyl)-, 1-acetate
  • Cyclohexanol, 4-(1,1-dimethylethyl)-, acetate
  • Cyclohexanol, 4-tert-butyl-, acetate (8CI)

Superlist Name

  • Cyclohexanol, 4-tert-butyl-, acetate

Registry Numbers

CAS Registry Number

  • 32210-23-4

FDA UNII

  • 21EUM2B8UC

Other Registry Numbers

  • 104-05-2
  • 449203-66-1

System Generated Number

  • 0032210234

Structure Descriptors

InChI

InChI=1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3

InChIKey

MBZRJSQZCBXRGK-UHFFFAOYSA-N

Smiles

CC(=O)OC1CCC(CC1)C(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 657, 1978.