Basic information
- CAS
5723-63-7- Standard SMILES
C=CC(OP(=O)(OCC)OCC)C(=O)N(C)C- InChIKey
WWFQNAHITCJRKH-UHFFFAOYSA-N- Molecular formula
- C10H20NO5P
- Average molar mass
- 265.24 g/mol
- Monoisotopic mass
- 265.10790974
Names & identifiers
- Preferred name
- AI 3-25503
- IUPAC
- [1-(dimethylamino)-1-oxobut-3-en-2-yl] diethyl phosphate
- English name
- Phosphoric acid diethyl=2-(dimethylcarbamoyl)-1-methylvinyl ester
- Molecular formula
- C10H20NO5P
- Molecular weight
- 265.24
Names & synonyms
5723-63-7AI 3-25503RefChem:10762341-(dimethylamino)-1-oxobut-3-en-2-yl diethyl phosphateShell SD-2244SD 2244ENT 25,503GC-4216BRN 1799413AI3-255032-(Dimethylcarbamoyl)-1-methylvinyl diethyl phosphateDTXSID50972728
Show more names
ENT-25503Phosphoric acid diethyl=2-(dimethylcarbamoyl)-1-methylvinyl esterPhosphoric acid, diethyl ester, ester with 3-hydroxy-N,N-dimethylcrotonamide (6CI,7CI,8CI)
Phosphoric acid, diethyl 1-(dimethylcarbamoyl)-1-propen-2-yl esterPhosphoric acid, 3-(dimethylamino)-1-methyl-3-oxo-1-propenyl diethyl esterPhosphoric acid, diethyl ester, ester with 3-hydroxy-N,N-dimethylcrotonamide4-04-00-00257 (Beilstein Handbook Reference)
Database identifiers
- CAS
5723-63-7- PubChem CID
- 110699
- DTXSID
DTXSID50972728
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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