4-Fluorobenz[a]anthracene

Product Name: 4-Fluorobenzanthracene (CAS NO.388-72-7)

Molecular Formula: C₁₈H₁₁F
Molecular Weight: 246.29g/mol
Mol File: 388-72-7.mol
Boiling point: 439.7 °C at 760 mmHg
Flash Point: 185.6 °C
Density: 1.256 g/cm³
Surface Tension: 51.8 dyne/cm
Enthalpy of Vaporization: 66.99 kJ/mol
Vapour Pressure: 1.61E-07 mmHg at 25°C
XLogP3-AA: 5.8
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of 4-Fluorobenzanthracene (CAS NO.388-72-7):
  IUPAC Name: 4-Fluorobenzo[a]anthracene
  Canonical SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4F
  InChI: InChI=1S/C18H11F/c19-18-7-3-6-15-16(18)9-8-14-10-12-4-1-2-5-13(12)11-17(14)15/h1-11H 
  InChIKey: NHEMFXZWMPLBQU-UHFFFAOYSA-N

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

 4-Fluorobenzanthracene , its CAS NO. is 388-72-7, the synonyms are 4'-Fluoro-1,2-benzanthracene ;
4-05-00-02551 (Beilstein Handbook Reference) ; 4-Fluorobenz(a)anthracene ; BRN 2560468  ; Benz(a)anthracene, 4-fluoro- .