n-(Dichloroacetyl)glycine
Basic information
- CAS
15102-51-9- Standard SMILES
O=C(O)CNC(=O)C(Cl)Cl- InChIKey
OANZIWQVCBABCH-UHFFFAOYSA-N- Molecular formula
- C4H5Cl2NO3
- Average molar mass
- 185.99 g/mol
- Monoisotopic mass
- 184.9646484
Names & identifiers
- Preferred name
- n-(Dichloroacetyl)glycine
- IUPAC
- 2-[(2,2-dichloroacetyl)amino]acetic acid
- English name
- 2-[(2,2-dichloroacetyl)amino]acetic acid
- Molecular formula
- C4H5Cl2NO3
- Molecular weight
- 185.99
Names & synonyms
15102-51-9n-(dichloroacetyl)glycine2-[(2,2-dichloroacetyl)amino]acetic acidNSC23842SCHEMBL11738091DTXSID30282019NSC-23842Glycine, N-(dichloroacetyl)- (6CI,8CI,9CI)
Database identifiers
- CAS
15102-51-9- PubChem CID
- 229838
- DTXSID
DTXSID30282019- Nikkaji
- J3.412.979G
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 147
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