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5385-75-1

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Basic Information
CAS No.: 5385-75-1
Name: DIBENZO(A,E)FLUORANTHENE
Article Data: 11
Molecular Structure:
Molecular Structure of 5385-75-1 (DIBENZO(A,E)FLUORANTHENE)
Formula: C24H14
Molecular Weight: 302.375
Synonyms: 2,3,5,6-Dibenzofluoranthene;Dibenzo[a,e]fluoranthene
Density: 1.313g/cm3
Melting Point: 232°C
Boiling Point: 552.3°C at 760 mmHg
Flash Point: 282°C
Hazard Symbols: 2120920
Risk Codes: 2120920
Safety: Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
PSA: 0.00000
LogP: 6.79360
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Chemistry

Product Name: Dibenzo(a,e)fluoranthene (CAS NO.5385-75-1)


Molecular Formula: C24H14
Molecular Weight: 302.37g/mol
Mol File: 5385-75-1.mol
Appearance: Yellow crystals
Boiling point: 552.3 °C at 760 mmHg
Storage Temperature: 2-8°C
Flash Point: 282 °C
Density: 1.313 g/cm3
Water Solubility: Water insoluble
Surface Tension: 66.4 dyne/cm
Enthalpy of Vaporization: 80.17 kJ/mol
Vapour Pressure: 1.12E-11 mmHg at 25°C
XLogP3-AA: 6.7
H-Bond Donor: 0
H-Bond Acceptor: 0
Structure Descriptors of Dibenzo(a,e)fluoranthene (CAS NO.5385-75-1):
  Canonical SMILES: C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C5=C3C2=CC6=CC=CC=C65
  InChI: InChI=1S/C24H14/c1-3-9-17-15(7-1)13-22-19-11-5-6-12-20(19)23-18-10-4-2-8-16(18)14-21(17)24(22)23/h1-14H 
  InChIKey: JHOWUOKQHJHGMU-UHFFFAOYSA-N
Product Categories: Alphabetic; D; DIA - DIC

Toxicity Data With Reference

1.    

mma-sat 500 nmol/L

     CRNGDP    Carcinogenesis. 5 (1984),1263.
2.    

dns-mus:emb 1 µmol/L

     CRNGDP    Carcinogenesis. 5 (1984),379.

Consensus Reports

IARC Cancer Review: Group 3 IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of chemicals to Man . 7 (1987),p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Limited Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of chemicals to Man . 32 (1983),p. 321.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210)

Safety Profile

Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.

Specification

 Dibenzo(a,e)fluoranthene ,its CAS NO. is 5385-75-1,the synonyms is 2,3,5,6-Dibenzofluoranthene ; 4-05-00-02801 (Beilstein Handbook Reference) ; BRN 2120920 ; CCRIS 6127 ; HSDB 6989 ; Dibenz(a,e)aceanthrylene .