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Basic information
- Standard SMILES
CCOC(=O)CNC(=O)CC(O)CBr- InChIKey
CQPVELBRIJTJPV-UHFFFAOYSA-N- Molecular formula
- C8H14BrNO4
- Average molar mass
- 268.1 g/mol
- Monoisotopic mass
- 267.01062
Names & identifiers
- Preferred name
- Ethyl 2-(4-bromo-3-hydroxybutanamido)acetate
- IUPAC
- ethyl 2-[(4-bromo-3-hydroxybutanoyl)amino]acetate
Names & synonyms
ethyl 2-(4-bromo-3-hydroxybutanamido)acetateSCHEMBL10625757CQPVELBRIJTJPV-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21284022
Properties
Computed structural propertiesFilling in
- XLogP
- -0.1
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
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