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Substance Name: 3-Cyclohexene-1,1-dimethanol
RN: 2160-94-3
InChIKey: YXEBFFWTZWGHEY-UHFFFAOYSA-N

Molecular Formula

  • C8-H14-O2

Molecular Weight

  • 142.197
 
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Names and Synonyms

Synonyms

  • 1,1-Bis(hydroxymethyl)-3-cyclohexene
  • 3-06-00-04131 (Beilstein Handbook Reference)
  • 4,4-Bis(hydroxymethyl)-1-cyclohexene
  • 4,4-Bis(hydroxymethyl)cyclohexene
  • BRN 2040659
  • EINECS 218-481-2
  • NSC 112688

Systematic Names

  • 3-Cyclohexene-1,1-dimethanol
  • Cyclohex-2-ene-1,1-dimethanol

Registry Numbers

CAS Registry Number

  • 2160-94-3

System Generated Number

  • 0002160943

Structure Descriptors

InChI

1S/C8H14O2/c9-6-8(7-10)4-2-1-3-5-8/h1-2,9-10H,3-7H2

InChIKey

YXEBFFWTZWGHEY-UHFFFAOYSA-N

Smiles

C1(CCC=CC1)(CO)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 2150mg/kg (2150mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 27, 1982.
mouse LD50 oral 1750mg/kg (1750mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 27, 1982.
rabbit LD50 oral 3400mg/kg (3400mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 27, 1982.
rat LD50 oral 1750mg/kg (1750mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 27, 1982.