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Substance Name: Phenyl biguanide
RN: 102-02-3
UNII: W8PKA3T2I3
InChIKey: CUQCMXFWIMOWRP-UHFFFAOYSA-N

Molecular Formula

  • C8-H11-N5

Molecular Weight

  • 177.2099
 

Classification Codes

  • Analgesics
  • Central Nervous System Agents
  • Drug / Therapeutic Agent
  • Hypoglycemic Agents
  • Neurotransmitter Agents
  • Peripheral Nervous System Agents
  • Sensory System Agents
  • Serotonin Agents
  • Serotonin Agonists
  • Serotonin Receptor Agonists
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Names and Synonyms

Name of Substance

  • Phenyl biguanide

Synonyms

  • 1-Phenylbiguanide
  • Biguanide, phenyl-
  • EINECS 202-998-5
  • N-Phenyl-N'-guanylguanidine
  • P 1426
  • Phenylbiguanide
  • Phenyldiguanide
  • Phenylguanide
  • UNII-W8PKA3T2I3

Systematic Names

  • 1-Phenylbiguanide
  • Biguanide, 1-phenyl-
  • Imidodicarbonimidic diamide, N-phenyl-

Registry Numbers

CAS Registry Number

  • 102-02-3

FDA UNII

  • W8PKA3T2I3

Related Registry Number

  • 55-57-2 (mono-hydrochloride)

System Generated Number

  • 0000102023

Structure Descriptors

InChI

1S/C8H11N5/c9-7(10)13-8(11)12-6-4-2-1-3-5-6/h1-5H,(H6,9,10,11,12,13)

InChIKey

CUQCMXFWIMOWRP-UHFFFAOYSA-N

Smiles

c1ccc(cc1)NC(=N)NC(=N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Medicina et Pharmacologia Experimentalis. Vol. 16, Pg. 267, 1967.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 143 deg C   EXP
log P (octanol-water) 0.500 (none)   EST
Atmospheric OH Rate Constant 1.27E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.