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Substance Name: 1,2-Epoxycyclohexane
RN: 286-20-4
UNII: 1XYE04C550
InChIKey: ZWAJLVLEBYIOTI-OLQVQODUSA-N

Note

  • Inhibitor of epoxide hydrase.

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C6-H10-O

Molecular Weight

  • 98.144
 
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Names and Synonyms

Name of Substance

  • 1,2-Epoxycyclohexane
  • Cyclohexene oxide

Synonyms

  • 1,2-Cyclohexene oxide
  • 1,2-Epoxycyclohexane
  • 7-Oxabicyclo(4.1.0)heptane
  • AI3-22170
  • CCHO
  • CCRIS 1227
  • Cyclohexane oxide
  • Cyclohexane, 1,2-epoxy-
  • Cyclohexene 1-oxide
  • Cyclohexene epoxide
  • Cyclohexene oxide
  • Cyclohexene-1-oxide
  • Cyclohexylene oxide
  • EC 206-007-7
  • EINECS 206-007-7
  • HSDB 5422
  • NSC 128074
  • Tetramethyleneoxirane
  • UNII-1XYE04C550

Systematic Names

  • 1,2-Epoxycyclohexane
  • 7-Oxabicyclo(4.1.0)heptane

Superlist Name

  • 7-Oxabicyclo(4.1.0)heptane

Registry Numbers

CAS Registry Number

  • 286-20-4

FDA UNII

  • 1XYE04C550

Other Registry Numbers

  • 137422-07-2
  • 26637-95-6
  • 28165-18-6

System Generated Number

  • 0000286204

Structure Descriptors

InChI

1S/C6H10O/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2/t5-,6+

InChIKey

ZWAJLVLEBYIOTI-OLQVQODUSA-N

Smiles

C1CC[C@@H]2O[C@@H]2C1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 1gm/kg (1000mg/kg)   Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962.
rabbit LD50 skin 630uL/kg (0.63mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.
rat LCLo inhalation 2000ppm/4H (2000ppm)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.
rat LD50 intraperitoneal 549mg/kg (549mg/kg) BEHAVIORAL: TREMOR Toxicology and Applied Pharmacology. Vol. 52, Pg. 422, 1980.
rat LD50 oral 1090uL/kg (1.09mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.00E+01 deg C   EXP
Boiling Point 131.5 deg C   EXP
log P (octanol-water) 1.660 (none)   EST
Atmospheric OH Rate Constant 6.37E-12 cm3/molecule-sec 25 EST

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