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Substance Name: 1-Cyano-1-hydroxycyclohexane
RN: 931-97-5
UNII: ON43942N5P
InChIKey: ZDBRPNZOTCHLSP-UHFFFAOYSA-N

Molecular Formula

  • C7-H11-N-O

Molecular Weight

  • 125.17
 
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Names and Synonyms

Name of Substance

  • 1-Cyano-1-hydroxycyclohexane

Synonyms

  • 1-Cyano-1-hydroxycyclohexane
  • 1-Hydroxycycloheptanecarbonitrile
  • 1-Hydroxycyclohexanecarbonitrile
  • 4-10-00-00021 (Beilstein Handbook Reference)
  • AI3-37039
  • BRN 1634973
  • CCRIS 4608
  • Cyclohexanecarbonitrile, 1-hydroxy-
  • Cyclohexanone cyanohydrin
  • Cyclohexanone, cyanohydrin
  • EINECS 213-246-0
  • NSC 14493
  • NSC 52190
  • UNII-ON43942N5P

Systematic Names

  • 1-Hydroxy-1-cyclohexanecarbonitrile
  • Cyclohexanecarbonitrile, 1-hydroxy-
  • Cyclohexanone cyanohydrin

Registry Numbers

CAS Registry Number

  • 931-97-5

FDA UNII

  • ON43942N5P

System Generated Number

  • 0000931975

Structure Descriptors

InChI

1S/C7H11NO/c8-6-7(9)4-2-1-3-5-7/h9H,1-5H2

InChIKey

ZDBRPNZOTCHLSP-UHFFFAOYSA-N

Smiles

C1(CCCCC1)(C#N)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04232,
rat LD50 oral 10mg/kg (10mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: GENERAL ANESTHETIC

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
National Technical Information Service. Vol. OTS0570906,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 35 deg C   EXP
log P (octanol-water) 1.330 (none)   EST
Atmospheric OH Rate Constant 1.31E-11 cm3/molecule-sec 25 EST

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