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Substance Name: 2-Propanol, 1-chloro-3-mercapto-
RN: 6478-04-2
InChIKey: VHPMKWNWJJDEEC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C3-H7-Cl-O-S

Molecular Weight

  • 126.606
 
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Names and Synonyms

Synonyms

  • 1-Chloro-3-mercapto-2-propanol
  • 3-01-00-02156 (Beilstein Handbook Reference)
  • BRN 1732056
  • EINECS 229-336-8

Systematic Names

  • 1-Chloro-3-mercaptopropan-2-ol
  • 2-Propanol, 1-chloro-3-mercapto-

Registry Numbers

CAS Registry Number

  • 6478-04-2

System Generated Number

  • 0006478042

Structure Descriptors

InChI

1S/C3H7ClOS/c4-1-3(5)2-6/h3,5-6H,1-2H2

InChIKey

VHPMKWNWJJDEEC-UHFFFAOYSA-N

Smiles

SC[C@@H](O)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 235, 1982.