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Substance Name: Biguanide, 1-(p-chlorophenyl)-5-isopropyl-5-methyl-, monoacetate
RN: 6712-60-3
InChIKey: BMZCSDMMUVZRRF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-Cl-N5.C2-H4-O2

Molecular Weight

  • 327.8138
 
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Names and Synonyms

Synonym

  • 1-(p-Chlorophenyl)-5-isopropyl-5-methylbiguanide monoacetate

Systematic Name

  • Biguanide, 1-(p-chlorophenyl)-5-isopropyl-5-methyl-, monoacetate

Registry Numbers

CAS Registry Number

  • 6712-60-3

System Generated Number

  • 0006712603

Molecular Formulas

Molecular Formula

  • C12-H18-Cl-N5.C2-H4-O2

Molecular Formula Fragments

  • C12-H18-Cl-N5
  • C2-H4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18ClN5.C2H4O2/c1-8(2)18(3)12(15)17-11(14)16-10-6-4-9(13)5-7-10;1-2(3)4/h4-8H,1-3H3,(H4,14,15,16,17);1H3,(H,3,4)

InChIKey

BMZCSDMMUVZRRF-UHFFFAOYSA-N

Smiles

CC(C)[NH+](C)C(=N)NC(=N)Nc1ccc(cc1)Cl.CC(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 80mg/kg (80mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 2, Pg. 181, 1947.