Glycine, N-(3-hydroxycrotonoyl)-, ethyl ester, dimethyl phosphate
Basic information
- CAS
63938-40-9- Standard SMILES
CCOC(=O)CNC(=O)/C=C(/C)OP(=O)(OC)OC- InChIKey
IZJUFCIOLRKNNM-VURMDHGXSA-N- Molecular formula
- C10H18NO7P
- Average molar mass
- 295.23 g/mol
- Monoisotopic mass
- 295.08208891
Names & identifiers
- Preferred name
- Glycine, N-(3-hydroxycrotonoyl)-, ethyl ester, dimethyl phosphate
- IUPAC
- ethyl 2-[[(Z)-3-dimethoxyphosphoryloxybut-2-enoyl]amino]acetate
Names & synonyms
63938-40-9GLYCINE, N-(3-HYDROXYCROTONOYL)-, ETHYL ESTER, DIMETHYL PHOSPHATERefChem:1086031Shell SD-6830ENT 25,716SD-6830Ethyl ((3-((dimethoxyphosphinyl)oxy)-1-oxo-2-butenyl)amino)acetateAcetic acid, ((3-((dimethoxyphosphinyl)oxy)-1-oxo-2-butenyl)amino)-, ethyl ester
Database identifiers
- CAS
63938-40-9- PubChem CID
- 6434776
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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