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Substance Name: 3-Aminofluoranthene
RN: 2693-46-1
UNII: 8UN5PRH090
InChIKey: VHGJAFIHUSTRGB-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C16-H11-N

Molecular Weight

  • 217.27
 
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Names and Synonyms

Name of Substance

  • 3-Aminofluoranthene

Synonyms

  • 3-Aminofluoranthene
  • 4-12-00-03463 (Beilstein Handbook Reference)
  • 4-Aminofluoranthene
  • BRN 2212365
  • CCRIS 7011
  • EINECS 220-263-7
  • NSC 57469
  • UNII-8UN5PRH090

Systematic Names

  • 3-Aminofluoranthene
  • 3-Fluoranthenamine
  • Fluoranthen-3-ylamine

Registry Numbers

CAS Registry Number

  • 2693-46-1

FDA UNII

  • 8UN5PRH090

System Generated Number

  • 0002693461

Structure Descriptors

InChI

1S/C16H11N/c17-15-9-8-13-11-5-2-1-4-10(11)12-6-3-7-14(15)16(12)13/h1-9H,17H2

InChIKey

VHGJAFIHUSTRGB-UHFFFAOYSA-N

Smiles

c12c3c4ccccc4c1cccc2c(N)cc3

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 115-117 deg C   EXP
log P (octanol-water) 4.2 (none)   EXP
Water Solubility 0.715 mg/L 25 EST
Vapor Pressure 1.59E-07 mm Hg 25 EST
Henry's Law Constant 2.93E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

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