BENZ(a)ANTHRACENE, 8-CHLORO-7-METHYL-
Basic information
- CAS
63018-67-7- Standard SMILES
Cc1c2ccc3ccccc3c2cc2cccc(Cl)c12- InChIKey
XAYRDRGETQOZJZ-UHFFFAOYSA-N- Molecular formula
- C19H13Cl
- Average molar mass
- 276.8 g/mol
- Monoisotopic mass
- 276.0705781
Names & identifiers
- Preferred name
- BENZ(a)ANTHRACENE, 8-CHLORO-7-METHYL-
- IUPAC
- 8-chloro-7-methylbenzo[a]anthracene
- English name
- 8-Chloro-7-methylbenz[a]anthracene
- Molecular formula
- C19H13Cl
- Molecular weight
- 276.76
Names & synonyms
63018-67-7BENZ(a)ANTHRACENE, 8-CHLORO-7-METHYL-8-Chloro-7-methylbenz(a)anthracene8-Chloro-7-methylbenz[a]anthraceneBenz[a]anthracene, 8-chloro-7-methyl-8-chloro-7-methyltetrapheneBRN 33078895-Chloro-10-methyl-1,2-benzanthraceneNSC1689173-05-00-02390 (Beilstein Handbook Reference)SCHEMBL8781236DTXSID30212250
Show more names
8-Chloro-7-methylbenzo[b]phenanthrene
NSC 168917NSC-168917DB-307477
Database identifiers
- CAS
63018-67-7- PubChem CID
- 44270
- DTXSID
DTXSID30212250- Nikkaji
- J73.180C
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 352
Physicochemical properties
- Boiling point
- 357.45 °C · 357.45°C (rough estimate)
- Density
- 1.1309 · 1.1309 (rough estimate)
- refractive index
- 1.6281 · 1.6281 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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