7-Chlorobenz(a)anthracene
Basic information
- CAS
20268-52-4- Standard SMILES
Clc1c2ccccc2cc2c1ccc1ccccc12- InChIKey
SBPAFMRNDOFNLB-UHFFFAOYSA-N- Molecular formula
- C18H11Cl
- Average molar mass
- 262.7 g/mol
- Monoisotopic mass
- 262.054928
Overview
structure given in first source
Names & identifiers
- Preferred name
- 7-Chlorobenz(a)anthracene
- IUPAC
- 7-chlorobenzo[a]anthracene
- English name
- 7-chlorobenz(a)anthracene
- Molecular formula
- C18H11Cl
- Molecular weight
- 262.73
Names & synonyms
7-Chlorobenz(a)anthracene20268-52-410-Chloro-1,2-benzanthraceneBenz(a)anthracene, 7-chloro-7-chlorobenz[a]anthracene2OZT3Q4Q8DDTXSID20174116J35.520HRefChem:105951DTXCID40966077-chlorotetraphene7-chlorobenzo[a]anthracene
Show more names
Benz[a]anthracene, 7-chloro-
7-CHLOROBENZO(A)ANTHRACENECCRIS 3878UNII-2OZT3Q4Q8DBRN 3294219SCHEMBL28366910Q27255281
Database identifiers
- CAS
20268-52-4- PubChem CID
- 88446
- DTXSID
DTXSID20174116- UNII
- 2OZT3Q4Q8D
- Nikkaji
- J35.520H
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Melting point
- 147 °C · 147°C
- Boiling point
- 340.72 °C · 340.72°C (rough estimate)
- Density
- 1.1547 · 1.1547 (rough estimate)
- refractive index
- 1.6281 · 1.6281 (estimate)
- FDA UNII
- 2 OZT3Q4Q8D · 2OZT3Q4Q8D
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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