Basic information
- CAS
149081-58-3- Standard SMILES
O=C(c1ccccc1)c1c(-c2ccccc2)ncc2ccccc12- InChIKey
IASFBDKKLQDIOF-UHFFFAOYSA-N- Molecular formula
- C22H15NO
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.1153641
Names & identifiers
- Preferred name
- Phenyl-(3-phenylisoquinolin-4-yl)methanone
- IUPAC
- phenyl-(3-phenylisoquinolin-4-yl)methanone
- English name
- Phenyl-(3-phenylisoquinolin-4-yl)methanone
- Molecular formula
- C22H15NO
- Molecular weight
- 309.36
Names & synonyms
Phenyl-(3-phenylisoquinolin-4-yl)methanone149081-58-3Phenyl(3-phenylisoquinolin-4-yl)methanoneDTXSID90462077DB-244729Methanone, phenyl(3-phenyl-4-isoquinolinyl)-
Database identifiers
- CAS
149081-58-3- PubChem CID
- 11312901
- DTXSID
DTXSID90462077- Nikkaji
- J1.703.044B
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 422
Chemistry & industry
Suppliers7 total
APAC Pharmaceutical, LLC[email protected]
TYGER[email protected]
上海洛茵氟化工有限公司[email protected]
上海维勒化工科技有限公司[email protected]
WATERSTONE[email protected]
FULCRUM—
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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