Basic information
- CAS
61738-08-7- Standard SMILES
Cc1ccc(F)c2ccc3c4ccccc4ccc3c12- InChIKey
XNAKJMFAMGFTJW-UHFFFAOYSA-N- Molecular formula
- C19H13F
- Average molar mass
- 260.3 g/mol
- Monoisotopic mass
- 260.10012858
Names & identifiers
- Preferred name
- 1-Fluoro-4-methylchrysene
- IUPAC
- 1-fluoro-4-methylchrysene
- English name
- 1-Fluoro-4-methylchrysene
- Molecular formula
- C19H13F
- Molecular weight
- 260.3
Names & synonyms
1-Fluoro-4-methylchrysene61738-08-7CHRYSENE, 1-FLUORO-4-METHYL-BRN 2531959FFM4PK8N4SFluoro-4-methylchrysene, 1-DTXSID20210740DB-2913901-Fluor-4-methylchrysen
Database identifiers
- CAS
61738-08-7- PubChem CID
- 43777
- DTXSID
DTXSID20210740- UNII
- FFM4PK8N4S
- Nikkaji
- J69.532G
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 352
Physicochemical properties
- FDA UNII
- 4 PK8N4S · FFM4PK8N4S
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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