N-Diazoacetyl-D,L-alanine ethyl ester
Basic information
- CAS
819-89-6- Standard SMILES
CCOC(=O)C(C)NC(=O)C=[N+]=[N-]- InChIKey
YVIPJKJKANZKIU-UHFFFAOYSA-N- Molecular formula
- C7H11N3O3
- Average molar mass
- 185.18 g/mol
- Monoisotopic mass
- 185.08004122
Names & identifiers
- Preferred name
- N-Diazoacetyl-D,L-alanine ethyl ester
- IUPAC
- ethyl 2-[(2-diazoacetyl)amino]propanoate
Names & synonyms
N-Diazoacetyl-D,L-alanine ethyl ester819-89-6CCRIS 925ALANINE, N-(DIAZOACETYL)-, ETHYL ESTER, D,L-N-diazoacetyl-dl-alanine ethyl ester
Database identifiers
- CAS
819-89-6- PubChem CID
- 13172
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 245
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Compound notes
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