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59417-86-6

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Basic Information
CAS No.: 59417-86-6
Name: 6-fluorobenzo(a)pyrene
Article Data: 1
Molecular Structure:
Molecular Structure of 59417-86-6 (6-fluorobenzo(a)pyrene)
Formula: C20H11F
Molecular Weight: 270.306
Synonyms: Benzo(a)pyrene,6-fluoro;6-Fluorobenzo(a)pyrene;
Density: 1.349g/cm3
Melting Point: 167-169 °C(Solv: acetone (67-64-1); methanol (67-56-1))
Boiling Point: 470.4°Cat760mmHg
Flash Point: 203.5°C
Safety: Suspected carcinogen with experimental carcinogenic and neoplastigenic data. When heated to decomposition it emits toxic fumes of F−.
PSA: 0.00000
LogP: 5.87630
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  • 6-FLUOROBENZO(a)PYRENE cas 59417-86-6

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    6-FLUOROBENZO(a)PYRENE cas 59417-86-6Appearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Chemistry

Product Name: 6-Fluorobenzo(a)pyrene (CAS NO.59417-86-6)


Molecular Formula: C20H11F
Molecular Weight: 270.31g/mol
Mol File: 59417-86-6.mol
Boiling point: 470.4 °C at 760 mmHg
Flash Point: 203.5°C
Density: 1.349g/cm3
Surface Tension: 61.3 dyne/cm
Enthalpy of Vaporization: 70.49 kJ/mol
Vapour Pressure: 1.44E-08 mmHg at 25°C
XLogP3-AA: 6.4
H-Bond Donor: 0
H-Bond Acceptor: 1
IUPAC Name: 6-fluorobenzo[a]pyrene
Canonical SMILES: C1=CC=C2C(=C1)C3=C4C(=C2F)C=CC5=CC=CC(=C54)C=C3
InChI: InChI=1S/C20H11F/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)
19(15)18(12)13/h1-11H 
InChIKey: WELROXOUKNZNRH-UHFFFAOYSA-N

Safety Profile

Suspected carcinogen with experimental carcinogenic and neoplastigenic data. When heated to decomposition it emits toxic fumes of F−.

Specification

 6-Fluorobenzo(a)pyrene ,its CAS NO. is 59417-86-6,the synonyms is Benzo(a)pyrene, 6-fluoro- .