3-(Dimethylamino)-2,2-diphenylpropanoic acid
Basic information
- CAS
5442-89-7- Standard SMILES
CN(C)CC(C(=O)O)(c1ccccc1)c1ccccc1- InChIKey
MFGWRWYYFNHJTP-UHFFFAOYSA-N- Molecular formula
- C17H19NO2
- Average molar mass
- 269.34 g/mol
- Monoisotopic mass
- 269.14157885
Names & identifiers
- Preferred name
- 3-(Dimethylamino)-2,2-diphenylpropanoic acid
- IUPAC
- 3-(dimethylamino)-2,2-diphenylpropanoic acid
Names & synonyms
5442-89-73-(dimethylamino)-2,2-diphenylpropanoic acidNSC13398Benzeneacetic acid, a-[(dimethylamino)methyl]-a-phenyl-DTXSID40279612NSC-13398DS-006805
Database identifiers
- CAS
5442-89-7- PubChem CID
- 224693
- DTXSID
DTXSID40279612
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
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Compound notes
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