Basic information
- CAS
5430-56-8- Standard SMILES
C[N+](C)([O-])Cc1cc(-c2ccccc2)ccc1O- InChIKey
ZVUMFYPRCOOMFA-UHFFFAOYSA-N- Molecular formula
- C15H17NO2
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.12592879
Names & identifiers
- Preferred name
- 1-(2-hydroxy-5-phenylphenyl)-N,N-dimethylmethanamine oxide
- IUPAC
- 1-(2-hydroxy-5-phenylphenyl)-N,N-dimethylmethanamine oxide
Names & synonyms
NSC138165430-56-8NSC-13816NCIStruc1_000453NCIStruc2_001085CHEMBL1741894DTXSID10279725NCI13816CCG-38166NCGC00013171NCGC00013171-02NCGC00096292-01
Show more names
NCI60_0008623-((hydroxy(dimethyl)-5-azanyl)methyl)[1,1'-biphenyl]-4-ol(4-Hydroxy[1,1'-biphenyl]-3-yl)-N,N-dimethylmethanamine N-oxide
Database identifiers
- CAS
5430-56-8- PubChem CID
- 224948
- DTXSID
DTXSID10279725- ChEMBL
CHEMBL1741894
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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