Basic information
- CAS
6622-12-4- Standard SMILES
O=C(O)CCC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
CAEZYMRXMHXIFU-UHFFFAOYSA-N- Molecular formula
- C23H21NO3
- Average molar mass
- 359.4 g/mol
- Monoisotopic mass
- 359.15214353
Names & identifiers
- Preferred name
- 4-Oxo-4-(tritylamino)butanoic acid
- IUPAC
- 4-oxo-4-(tritylamino)butanoic acid
Names & synonyms
4-Oxo-4-(tritylamino)butanoic acid8MBX0A2RW16622-12-4UNII-8MBX0A2RW1NSC 56481NSC-56481DTXSID30216410SUCCINAMIC ACID, N-TRITYL-BUTANOIC ACID, 4-OXO-4-((TRIPHENYLMETHYL)AMINO)-RefChem:100264DTXCID30138901NSC56481
Show more names
SCHEMBL298721514-Oxo-4-[(triphenylmethyl)amino]butanoic acid
Database identifiers
- CAS
6622-12-4- PubChem CID
- 245017
- DTXSID
DTXSID30216410- UNII
- 8MBX0A2RW1
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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