Basic information
- CAS
6969-61-5- Standard SMILES
O=C(NC(C(=O)O)c1ccccc1)C(Cl)Cl- InChIKey
RWFMAOOBMAQUMV-UHFFFAOYSA-N- Molecular formula
- C10H9Cl2NO3
- Average molar mass
- 262.09 g/mol
- Monoisotopic mass
- 260.9959485
Names & identifiers
- Preferred name
- [(Dichloroacetyl)amino](phenyl)acetic acid
- IUPAC
- 2-[(2,2-dichloroacetyl)amino]-2-phenylacetic acid
Names & synonyms
6969-61-5[(dichloroacetyl)amino](phenyl)acetic acidNSC68441DTXSID50290393NSC-68441(2,2-DICHLOROACETAMIDO)(PHENYL)ACETIC ACID
Database identifiers
- CAS
6969-61-5- PubChem CID
- 249762
- DTXSID
DTXSID50290393
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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