7-Methyl-2-fluorobenz[a]anthracene
Basic information
- CAS
1994-57-6- Standard SMILES
Cc1c2ccccc2cc2c1ccc1ccc(F)cc12- InChIKey
CCGBZTMYGNQCBD-UHFFFAOYSA-N- Molecular formula
- C19H13F
- Average molar mass
- 260.3 g/mol
- Monoisotopic mass
- 260.10012858
Names & identifiers
- Preferred name
- 7-Methyl-2-fluorobenz[a]anthracene
- IUPAC
- 2-fluoro-7-methylbenzo[a]anthracene
- English name
- 2-Fluoro-7-methylbenz[a]anthracene
- Molecular formula
- C19H13F
- Molecular weight
- 260.3
Names & synonyms
1994-57-62-Fluoro-7-methylbenz[a]anthracene2-fluoro-7-methylbenzo[a]anthracene7-Methyl-2-fluorobenz[a]anthraceneBenz(a)anthracene, 2-fluoro-7-methyl-2-Fluoro-7-methylbenz(a)anthracene7-Methyl-2-fluorobenz(a)anthraceneNSC-409640Benz[a]anthracene, 2-fluoro-7-methyl-NSC 4096402-fluoro-7-methyltetrapheneBRN 2532110
Show more names
NSC4096402ECM62E64ADTXSID30173716WLN: L D6 B666J J1 QF
Database identifiers
- CAS
1994-57-6- PubChem CID
- 101387
- DTXSID
DTXSID30173716- UNII
- 2ECM62E64A
- Nikkaji
- J35.547J
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
- Boiling point
- 227.76 °C · 227.76°C (rough estimate)
- Density
- 1.0669 · 1.0669 (rough estimate)
- refractive index
- 1.73 · 1.7300 (estimate)
- FDA UNII
- 2 ECM62E64A · 2ECM62E64A
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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