Basic information
- CAS
151678-34-1- Standard SMILES
Nc1cccc(C=CC(=O)c2cccc(N)c2)c1- InChIKey
AOKSIVVSCQOMRN-UHFFFAOYSA-N- Molecular formula
- C15H14N2O
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.11061307
Names & identifiers
- Preferred name
- 2-Propen-1-one, 1,3-bis(3-aminophenyl)-
- IUPAC
- 1,3-bis(3-aminophenyl)prop-2-en-1-one
Names & synonyms
2-Propen-1-one, 1,3-bis(3-aminophenyl)-151678-34-1DTXSID80338353RefChem:266108DTXCID402894381,3-bis(3-aminophenyl)prop-2-en-1-one3,3'-diaminochalconeSCHEMBL3002283
Database identifiers
- CAS
151678-34-1- PubChem CID
- 548639
- DTXSID
DTXSID80338353
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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