Basic information
- CAS
3186-35-4- Standard SMILES
CP(C)(=S)Oc1ccc([N+](=O)[O-])cc1- InChIKey
WYZDYCDKZOHZOM-UHFFFAOYSA-N- Molecular formula
- C8H10NO3PS
- Average molar mass
- 231.21 g/mol
- Monoisotopic mass
- 231.01190135
Names & identifiers
- Preferred name
- Phosphinothioic acid, dimethyl-, O-(p-nitrophenyl) ester
- IUPAC
- dimethyl-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane
Names & synonyms
BRN 19696473186-35-4Phosphinothioic acid, dimethyl-, O-(p-nitrophenyl) esterO-4-Nitrophenyl dimethylphosphinothioateDTXSID40185724RefChem:370303DTXCID80108215O-(4-nitrophenyl) dimethylphosphinothioateSCHEMBL14095660
Database identifiers
- CAS
3186-35-4- PubChem CID
- 201071
- DTXSID
DTXSID40185724- Nikkaji
- J2.191.946B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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