Benz(a)anthracene, 6-fluoro-7-methyl-
Basic information
- CAS
2541-68-6- Standard SMILES
Cc1c2ccccc2cc2c1c(F)cc1ccccc12- InChIKey
YTMJGWZZUJCJPE-UHFFFAOYSA-N- Molecular formula
- C19H13F
- Average molar mass
- 260.3 g/mol
- Monoisotopic mass
- 260.10012858
Names & identifiers
- Preferred name
- Benz(a)anthracene, 6-fluoro-7-methyl-
- IUPAC
- 6-fluoro-7-methylbenzo[a]anthracene
- English name
- 6-Fluoro-7-methylbenz[a]anthracene
- Molecular formula
- C19H13F
- Molecular weight
- 260.3
Names & synonyms
Benz(a)anthracene, 6-fluoro-7-methyl-6-Fluoro-7-methylbenz[a]anthracene2541-68-6BRN 25321066-FLUORO-7-METHYLBENZ(A)ANTHRACENEDTXSID80180071RefChem:117060DTXCID90102562YTMJGWZZUJCJPE-UHFFFAOYSA-N6-fluoro-7-methyltetrapheneBenz[a]anthracene, 6-fluoro-7-methyl-
Database identifiers
- CAS
2541-68-6- PubChem CID
- 17346
- DTXSID
DTXSID80180071- Nikkaji
- J35.549F
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)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Compound notes
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