N-(Bromoacetyl)glycine, ethyl ester
Basic information
- CAS
15088-70-7- Standard SMILES
CCOC(=O)CNC(=O)CBr- InChIKey
QMUFODNSESUOCC-UHFFFAOYSA-N- Molecular formula
- C6H10BrNO3
- Average molar mass
- 224.05 g/mol
- Monoisotopic mass
- 222.98441
Names & identifiers
- Preferred name
- N-(Bromoacetyl)glycine, ethyl ester
- IUPAC
- ethyl 2-[(2-bromoacetyl)amino]acetate
Names & synonyms
N-(Bromoacetyl)glycine, ethyl ester15088-70-7CCRIS 1814Glycine, N-(bromoacetyl)-, ethyl esterNSC 79644DTXSID00164636RefChem:362605DTXCID8087127NSC-79644ethyl n-(bromoacetyl)glycinateNSC79644N-(2-bromoacetyl)glycine ethyl ester
Show more names
K7C2Q8TS6USCHEMBL1496151QMUFODNSESUOCC-UHFFFAOYSA-NAKOS012989440Glycine,n-(2-bromoacetyl)-, ethyl esterDS-011142Glycine, N-(2-bromoacetyl)-, ethyl ester(2-bromo-acetylamino)-acetic acid ethyl ester
Database identifiers
- CAS
15088-70-7- PubChem CID
- 96555
- DTXSID
DTXSID00164636- UNII
- K7C2Q8TS6U
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
2 records
Compound notes
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