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Substance Name: Naphtho(2,1-a)fluoranthene
RN: 203-20-3
InChIKey: ZUAGUFSITPHNKC-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C24-H14

Molecular Weight

  • 302.375
 
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Names and Synonyms

Name of Substance

  • Naphtho(2,1-a)fluoranthene

Synonyms

  • 15,16-Benzodehydrocholanthrene
  • 3-05-00-02618 (Beilstein Handbook Reference)
  • BRN 2377394
  • Naphtho(2,1-a)fluoranthene

Systematic Name

  • Dibenz(a,j)aceanthrylene

Registry Numbers

CAS Registry Number

  • 203-20-3

System Generated Number

  • 0000203203

Structure Descriptors

InChI

1S/C24H14/c1-2-8-17-15(6-1)12-13-21-22(17)14-16-7-5-11-19-18-9-3-4-10-20(18)24(21)23(16)19/h1-14H

InChIKey

ZUAGUFSITPHNKC-UHFFFAOYSA-N

Smiles

c12c3c(cccc3cc3c1ccc1c3cccc1)c1c2cccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 10mg/kg (10mg/kg)   Journal of the National Cancer Institute. Vol. 1, Pg. 225, 1940.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 7.280 (none)   EST
Water Solubility .001 mg/L 27 EXP
Vapor Pressure 1.15E-10 mm Hg 25 EST
Henry's Law Constant 7.91E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.45E-11 cm3/molecule-sec 25 EST

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