Completing data — refresh the page later to see the latest
Basic information
- CAS
2917-21-7- Standard SMILES
CCP(=S)(OC)Oc1ccc([N+](=O)[O-])cc1Cl- InChIKey
GBSHLOCYYUYGCZ-UHFFFAOYSA-N- Molecular formula
- C9H11ClNO4PS
- Average molar mass
- 295.68 g/mol
- Monoisotopic mass
- 294.9834937
Names & identifiers
- Preferred name
- O-(2-Chloro-4-nitrophenyl) O-methyl ethylphosphonothioate
- IUPAC
- (2-chloro-4-nitrophenoxy)-ethyl-methoxy-sulfanylidene-lambda5-phosphane
- English name
- O-(2-Chloro-4-nitrophenyl)O-methyl=ethylphosphonothioate
- Molecular weight
- 0
Names & synonyms
O-(2-Chloro-4-nitrophenyl) O-methyl ethylphosphonothioate2917-21-7DTXSID20951767RefChem:1093551DTXCID201379878Stauffer N-2310BRN 1887738ENT 25,769ENT 25769Phosphonothioic acid, ethyl-, O-(2-chloro-4-nitrophenyl) O-methyl esterENT-25769O-(2-Chloro-4-nitrophenyl)O-methyl=ethylphosphonothioate
Database identifiers
- CAS
2917-21-7- PubChem CID
- 76211
- DTXSID
DTXSID20951767- Nikkaji
- J53.780B
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 96.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…