Basic information
- CAS
5745-22-2- Standard SMILES
CCCP(=S)(CCC)Oc1ccc([N+](=O)[O-])cc1- InChIKey
LORFACHPWQDSTM-UHFFFAOYSA-N- Molecular formula
- C12H18NO3PS
- Average molar mass
- 287.32 g/mol
- Monoisotopic mass
- 287.07450161
Names & identifiers
- Preferred name
- Phosphinothioic acid, dipropyl-, O-(p-nitrophenyl) ester
- IUPAC
- (4-nitrophenoxy)-dipropyl-sulfanylidene-λ5-phosphane
- English name
- Dipropylthiophosphinic acid O-(4-nitrophenyl) ester
- Molecular formula
- C12H18NO3PS
- Molecular weight
- 287.32
Names & synonyms
5745-22-2Phosphinothioic acid, dipropyl-, O-(p-nitrophenyl) esterDTXSID20206062RefChem:1095123DTXCID20128553o-(4-nitrophenyl) dipropylphosphinothioateNSC 132989BRN 2138170Dipropylphosphinothioic acid O-(p-nitrophenyl) esterO-(p-Nitrophenyl) dipropylphosphinothioateO-p-Nitrofenylester kyselinyl dipropylthiofosfinove [Czech]O-p-Nitrofenylester kyselinyl dipropylthiofosfinove
Show more names
Phosphinothioic acid, dipropyl-, O-(p-nitrophenyl) ester (7CI,8CI)
Dipropylthiophosphinic acid O-(4-nitrophenyl) esterWLN: WNR DOPS&3&3NSC132989NSC-132989Phosphinothioic acid, O-(p-nitrophenyl) ester
Database identifiers
- CAS
5745-22-2- PubChem CID
- 79820
- DTXSID
DTXSID20206062- Nikkaji
- J50.269C
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 301
Physicochemical properties
- Boiling point
- 388.1 · 388.1±44.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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