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Substance Name: 3-Butyn-2-ol, 4-chloro-2-cyclopropyl-
RN: 77985-09-2
InChIKey: YUCPOSFMWSABII-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H9-Cl-O

Molecular Weight

  • 144.6001
 
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Names and Synonyms

Synonyms

  • 4-06-00-00342 (Beilstein Handbook Reference)
  • 4-Chloro-2-cyclopropyl-3-butyn-2-ol
  • BRN 3234362

Systematic Name

  • 3-Butyn-2-ol, 4-chloro-2-cyclopropyl-

Registry Numbers

CAS Registry Number

  • 77985-09-2

System Generated Number

  • 0077985092

Structure Descriptors

InChI

1S/C7H9ClO/c1-7(9,4-5-8)6-2-3-6/h6,9H,2-3H2,1H3

InChIKey

YUCPOSFMWSABII-UHFFFAOYSA-N

Smiles

CC(C#CCl)(C1CC1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 650mg/kg (650mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 7, Pg. 85, 1957.
mouse LD50 subcutaneous 520mg/kg (520mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 109, Pg. 268, 1953.