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Substance Name: Fluorene
RN: 86-73-7
UNII: 3Q2UY0968A
InChIKey: NIHNNTQXNPWCJQ-UHFFFAOYSA-N

Molecular Formula

  • C13-H10

Molecular Weight

  • 166.222
 

Classification Codes

Classification Codes

  • Carcinogens
  • Drug / Therapeutic Agent
  • Mutation Data
  • Noxae
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 3
  • Reportable Quantity (RQ) = 5000 lb
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Names and Synonyms

Name of Substance

  • Fluorene

Synonyms

  • 2,2'-Methylenebiphenyl
  • 2,3-Benzindene
  • 9H-Fluorene
  • AI3-09074
  • CCRIS 947
  • Diphenylenemethane
  • EC 201-695-5
  • EINECS 201-695-5
  • Fluorene
  • HSDB 2165
  • Methane, diphenylene-
  • NSC 6787
  • o-Biphenylenemethane
  • o-Biphenylmethane
  • UNII-3Q2UY0968A

Systematic Names

  • 9H-Fluorene
  • Fluorene

Superlist Names

  • 9H-Fluorene
  • Fluorene

Registry Numbers

CAS Registry Number

  • 86-73-7

FDA UNII

  • 3Q2UY0968A

Other Registry Number

  • 84987-80-4

System Generated Number

  • 0000086737

Structure Descriptors

InChI

1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2

InChIKey

NIHNNTQXNPWCJQ-UHFFFAOYSA-N

Smiles

c12c3c(cccc3)Cc1cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 19, Pg. 326, 1985.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 114.8 deg C   EXP
Boiling Point 295 deg C   EXP
log P (octanol-water) 4.18 (none)   EXP
Water Solubility 1.69 mg/L 25 EXP
Vapor Pressure 6.00E-04 mm Hg 25 EXP
Henry's Law Constant 9.62E-05 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 1.30E-11 cm3/molecule-sec 25 EXP

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