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Substance Name: Benz(c)acridine
RN: 225-51-4
UNII: BV4376Y90X
InChIKey: OAPPEBNXKAKQGS-UHFFFAOYSA-N

Molecular Formula

  • C17-H11-N

Molecular Weight

  • 229.281
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 3
  • Reportable Quantity (RQ) = 100 lb
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Names and Synonyms

Name of Substance

  • Benz(c)acridine

Synonyms

  • 12-Azabenz(a)anthracene
  • 3,4-Benzacridine
  • 3,4-Benzoacridine
  • 5-20-08-00519 (Beilstein Handbook Reference)
  • 7,8-Benzacridine
  • 7,8-Benzacridine [French]
  • alpha-Chrysidine
  • alpha-Naphthacridine
  • B(c)AC
  • Benz(c)acridine
  • BRN 0154999
  • CCRIS 2465
  • EINECS 205-930-2
  • HSDB 5094
  • NSC 89261
  • RCRA waste number U016
  • UNII-BV4376Y90X

Systematic Name

  • Benz(c)acridine

Superlist Names

  • Benz(c)acridine
  • RCRA waste no. U016

Registry Numbers

CAS Registry Number

  • 225-51-4

FDA UNII

  • BV4376Y90X

System Generated Number

  • 0000225514

Structure Descriptors

InChI

InChI=1S/C17H11N/c1-3-7-15-12(5-1)9-10-14-11-13-6-2-4-8-16(13)18-17(14)15/h1-11H

InChIKey

OAPPEBNXKAKQGS-UHFFFAOYSA-N

Smiles

c1ccc2nc3c(ccc4ccccc34)cc2c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 132 deg C   EXP
pKa Dissociation Constant 4.7 (none) 20 EXP
log P (octanol-water) 4.490 (none)   EST
Water Solubility 0.346 mg/L 25 EST
Vapor Pressure 3.49E-07 mm Hg 25 EST
Henry's Law Constant 1.41E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.80E-11 cm3/molecule-sec 25 EST

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