Basic information
- CAS
40911-36-2- Standard SMILES
O=P(Oc1ccccc1)(Oc1ccccc1)C(Cl)Cl- InChIKey
JYVKVDGSFLTXME-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2O3P
- Average molar mass
- 317.1 g/mol
- Monoisotopic mass
- 315.9822866
Overview
anti-rice blast agent
Names & identifiers
- Preferred name
- Dichloromethyl O,O-diphenyl phosphonate
- IUPAC
- [dichloromethyl(phenoxy)phosphoryl]oxybenzene
- English name
- dichloromethyl O,O-diphenyl phosphonate
- Molecular formula
- C13H11Cl2O3P
- Molecular weight
- 317.1
Names & synonyms
Dichloromethyl O,O-diphenyl phosphonate40911-36-2DTXSID80193909(Dichloromethyl)phosphonic acid, diphenylRefChem:133079DTXCID70116400[dichloromethyl(phenoxy)phosphoryl]oxybenzenediphenyl (dichloromethyl)phosphonateSCHEMBL27941380Phosphonic acid, (dichloromethyl)-, diphenyl ester (9CI)
Database identifiers
- CAS
40911-36-2- PubChem CID
- 38705
- DTXSID
DTXSID80193909- Nikkaji
- J1.619.822F
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 289
Physicochemical properties
- Boiling point
- 382.7 · 382.7±42.0 °C(Predicted)
- Density
- 1.383 · 1.383±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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