Basic information
- CAS
5345-43-7- Standard SMILES
NC(=O)c1ccc2ccc3ccccc3c2c1- InChIKey
VJLPGQYJETUIQE-UHFFFAOYSA-N- Molecular formula
- C15H11NO
- Average molar mass
- 221.25 g/mol
- Monoisotopic mass
- 221.08406397
Names & identifiers
- Preferred name
- 3-Phenanthrenecarboxamide
- IUPAC
- phenanthrene-3-carboxamide
Names & synonyms
5345-43-73-PhenanthrenecarboxamideNSC3041SCHEMBL1004717SCHEMBL2887371Phenanthrene-3-carboximidic acidDTXSID50968126NSC-3041
Database identifiers
- CAS
5345-43-7- PubChem CID
- 220397
- DTXSID
DTXSID50968126
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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