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Substance Name: 4-Isopropylcyclohexanol
RN: 4621-04-9
UNII: 3N745V536F
InChIKey: DKKRDMLKVSKFMJ-UHFFFAOYSA-N

Note

  • Inhibits calcium-activated chloride channel anoctamin 1 (ANO1), TRPV1 and TRPA1 channels; has potential analgesic effect in mice.

Molecular Formula

  • C9-H18-O

Molecular Weight

  • 142.24
 

Classification Code

  • Skin / Eye Irritant
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Names and Synonyms

Name of Substance

  • 4-Isopropylcyclohexanol

Synonyms

  • 2-06-00-00035 (Beilstein Handbook Reference)
  • 4-Isopropylcyclohexanol
  • AI3-18156
  • BRN 2322224
  • Cyclohexanol, p-isopropyl-
  • EINECS 225-035-0
  • NSC 21123
  • p-Isopropylcyclohexanol
  • UNII-3N745V536F

Systematic Names

  • 4-Isopropylcyclohexanol
  • Cyclohexanol, 4-(1-methylethyl)-
  • Cyclohexanol, 4-isopropyl- (8CI)
  • Cyclohexanol, p-isopropyl-

Registry Numbers

CAS Registry Number

  • 4621-04-9

FDA UNII

  • 3N745V536F

System Generated Number

  • 0004621049

Structure Descriptors

InChI

InChI=1S/C9H18O/c1-7(2)8-3-5-9(10)6-4-8/h7-10H,3-6H2,1-2H3

InChIKey

DKKRDMLKVSKFMJ-UHFFFAOYSA-N

Smiles

CC(C)C1CCC(O)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2750mg/kg (2750mg/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 803, 1978.