Basic information
- CAS
297-99-4- Standard SMILES
CCN(CC)C(=O)/C(Cl)=C(/C)OP(=O)(OC)OC- InChIKey
RGCLLPNLLBQHPF-CMDGGOBGSA-N- Molecular formula
- C10H19ClNO5P
- Average molar mass
- 299.69 g/mol
- Monoisotopic mass
- 299.0689374
Names & identifiers
- Preferred name
- trans-Phosphamidon
- IUPAC
- [(E)-3-chloro-4-(diethylamino)-4-oxobut-2-en-2-yl] dimethyl phosphate
Names & synonyms
trans-Phosphamidon297-99-4Phosphamidon, (E)-54VR7A0BQDDTXSID5058357RefChem:1100279DTXCID9032088(E)-PhosphamidonENT 25,515[(E)-3-chloro-4-(diethylamino)-4-oxobut-2-en-2-yl] dimethyl phosphatePhosphoric acid, 2-chloro-3-(diethylamino)-1-methyl-3-oxo-1-propenyl dimethyl ester, (E)-UNII-54VR7A0BQD
Show more names
E-PhosphamidonPhosphamidon (isomer)Dimethyl 2-chloro-2-diethylcarbamoyl-methyl vinyl phosphatePHOSPHAMIDON, TRANS-PHOSPHAMIDON, E ISOMERSCHEMBL3675777MSK20656Phosphamidon 10 microg/mL in Cyclohexane
Database identifiers
- CAS
297-99-4- PubChem CID
- 3033834
- DTXSID
DTXSID5058357- UNII
- 54VR7A0BQD
- Nikkaji
- J437.687K
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 359
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Other Safety InformationIMAP assessments - Phosphoric acid, 2-chloro-3-(diethylamino)-1-methyl-3-oxo-1-propenyl dimethyl ester, (E)-: Human health tier I assessment
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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