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Substance Name: (Hydroxyimino)cyclohexane
RN: 100-64-1
UNII: 2U60L00CGF
InChIKey: VEZUQRBDRNJBJY-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data
  • Tumor Data

Molecular Formula

  • C6-H11-N-O

Molecular Weight

  • 113.1589
 
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Names and Synonyms

Name of Substance

  • (Hydroxyimino)cyclohexane
  • Cyclohexanone oxime

Synonyms

  • (Hydroxyimino)cyclohexane
  • 4-07-00-00021 (Beilstein Handbook Reference)
  • AI3-07288
  • Antioxidant D
  • BRN 1616769
  • CCRIS 1383
  • Cyclohexanone oxime
  • Cyclohexanone, oxime
  • EC 202-874-0
  • EINECS 202-874-0
  • HSDB 5337
  • NSC 6300
  • UNII-2U60L00CGF

Systematic Names

  • Cyclohexanone oxime
  • Cyclohexanone, oxime

Superlist Names

  • Cyclohexanone oxime
  • Cyclohexanone, oxime

Registry Numbers

CAS Registry Number

  • 100-64-1

FDA UNII

  • 2U60L00CGF

Other Registry Numbers

  • 1071540-61-8
  • 136056-95-6
  • 136057-01-7

System Generated Number

  • 0000100641

Structure Descriptors

InChI

1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h8H,1-5H2

InChIKey

VEZUQRBDRNJBJY-UHFFFAOYSA-N

Smiles

C1CCC(=NO)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   National Technical Information Service. Vol. AD691-490,
mouse LD50 unreported 710mg/kg (710mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Pharmaceutical Chemistry Journal Vol. 12, Pg. 227, 1978.
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 26, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 90 deg C   EXP
Boiling Point 206 deg C   EXP
log P (octanol-water) 0.84 (none)   EXP
Water Solubility 1.80E+04 mg/L 25 EXP
Henry's Law Constant 8.05E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.07E-12 cm3/molecule-sec 25 EST

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