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Substance Name: Dibenz(a,h)acridine
RN: 226-36-8
UNII: I64KK77PZY
InChIKey: JNCSIWAONQTVCF-UHFFFAOYSA-N

Molecular Formula

  • C21-H13-N

Molecular Weight

  • 279.341
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 2B
  • Reasonably Anticipated to be a Carcinogen
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Names and Synonyms

Name of Substance

  • Dibenz(a,h)acridine

Synonyms

  • 1,2,5,6-Dibenzacridine
  • 1,2,5,6-Dibenzoacridine
  • 1,2,5,6-Dinaphthacridine
  • 5-20-08-00657 (Beilstein Handbook Reference)
  • 7-Azadibenz(a,h)anthracene
  • BRN 0209261
  • CCRIS 206
  • DB(a,h)AC
  • Dibenz(a,d)acridine
  • Dibenz(a,h)acridine
  • HSDB 4038
  • UNII-I64KK77PZY

Systematic Name

  • Dibenz(a,h)acridine

Superlist Names

  • Dibenz(a,h)acridine
  • Dibenz(a,h)acridine [Polycyclic aromatic compounds]
  • Dibenz(a,h)acridine [Polycyclic aromatic hydrocarbons]

Registry Numbers

CAS Registry Number

  • 226-36-8

FDA UNII

  • I64KK77PZY

System Generated Number

  • 0000226368

Structure Descriptors

InChI

1S/C21H13N/c1-3-7-17-14(5-1)11-12-20-19(17)13-16-10-9-15-6-2-4-8-18(15)21(16)22-20/h1-13H

InChIKey

JNCSIWAONQTVCF-UHFFFAOYSA-N

Smiles

c12c3c(ccc1nc1c4c(cccc4)ccc1c2)cccc3

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 226 deg C   EXP
log P (octanol-water) 5.73 (none)   EXP
Water Solubility 0.159 mg/L 25 EXP
Vapor Pressure 1.85E-09 mm Hg 25 EST
Henry's Law Constant 1.90E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.00E-11 cm3/molecule-sec 25 EST

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