1-Fluorobenzo(a)pyrene
Basic information
- CAS
150765-66-5- Standard SMILES
Fc1ccc2ccc3cc4ccccc4c4ccc1c2c34- InChIKey
VHALAGXODIENSE-UHFFFAOYSA-N- Molecular formula
- C20H11F
- Average molar mass
- 270.3 g/mol
- Monoisotopic mass
- 270.08447851
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-Fluorobenzo(a)pyrene
- IUPAC
- 1-fluorobenzo[a]pyrene
- English name
- 1-fluorobenzo(a)pyrene
- Molecular formula
- C20H11F
- Molecular weight
- 270.3
Names & synonyms
1-Fluorobenzo(a)pyrene150765-66-5DTXSID10164607RefChem:75814DTXCID8087098Benzo(a)pyrene, 1-fluoro-fluorobenzo[a]pyrene1-Fluorobenzo[pqr]tetrapheneBenzo[a]pyrene, 1-fluoro- (9CI)
Database identifiers
- CAS
150765-66-5- PubChem CID
- 164491
- DTXSID
DTXSID10164607- Nikkaji
- J557.976G
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 405
Physicochemical properties
- Comptox DTXSID
- 10164607 · DTXSID10164607
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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