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Substance Name: 2,3-Butanediol, 3-methyl-1,1,1-trichloro-
RN: 25448-85-5
InChIKey: WWQAIJNBPAEZTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H9-Cl3-O2

Molecular Weight

  • 207.483
 
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Names and Synonyms

Synonyms

  • 1,1,1-Trichloro-3-methylbutane-2,3-diol
  • BRN 2071209

Systematic Name

  • 2,3-Butanediol, 3-methyl-1,1,1-trichloro-

Registry Numbers

CAS Registry Number

  • 25448-85-5

System Generated Number

  • 0025448855

Structure Descriptors

InChI

1S/C5H9Cl3O2/c1-4(2,10)3(9)5(6,7)8/h3,9-10H,1-2H3

InChIKey

WWQAIJNBPAEZTE-UHFFFAOYSA-N

Smiles

C([C@@H](C(C)(O)C)O)(Cl)(Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 640mg/kg (640mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 527, 1971.