Basic information
- CAS
74084-50-7- Standard SMILES
COC(=O)C(NC(=O)CCl)C(=O)OC- InChIKey
FATSLTXZAZDMPY-UHFFFAOYSA-N- Molecular formula
- C7H10ClNO5
- Average molar mass
- 223.61 g/mol
- Monoisotopic mass
- 223.0247501
Names & identifiers
- Preferred name
- Dimethyl[(chloroacetyl)amino]propanedioate
- IUPAC
- dimethyl 2-[(2-chloroacetyl)amino]propanedioate
Names & synonyms
74084-50-7dimethyl[(chloroacetyl)amino]propanedioateNSC145676SCHEMBL15067539DTXSID70301672NSC-145676Dimethyl (2-chloroacetamido)propanedioate
Database identifiers
- CAS
74084-50-7- PubChem CID
- 286704
- DTXSID
DTXSID70301672
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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