Basic information
- CAS
82507-21-9- Standard SMILES
Nc1cc2cc3ccccc3c3ccc4cccc1c4c23- InChIKey
BJHPDTFXCVOKGZ-UHFFFAOYSA-N- Molecular formula
- C20H13N
- Average molar mass
- 267.3 g/mol
- Monoisotopic mass
- 267.10479942
Names & identifiers
- Preferred name
- 4-Aminobenzo(a)pyrene
- IUPAC
- benzo[a]pyren-4-amine
- English name
- 4-Aminobenzo(a)pyrene
- Molecular weight
- 0
Names & synonyms
4-Aminobenzo(a)pyrene82507-21-9Benzo(a)pyrene-4-amineDTXSID00231812RefChem:912340DTXCID30154303Benzo[a]pyrene, 7-aminoBENZO(a)PYREN-4-AMINEbenzo[pqr]tetraphen-4-amineBJHPDTFXCVOKGZ-UHFFFAOYSA-N
Database identifiers
- CAS
82507-21-9- PubChem CID
- 54878
- DTXSID
DTXSID00231812- Nikkaji
- J132.099H
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 405
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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