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1-Fluorobenzo(a)pyrene

HCID 164491
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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 propertiesFilling in

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

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Compound notes

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