Phosphinothioic acid, dimethyl-, O-(3-methyl-4-(methylthio)phenyl) ester
Basic information
- CAS
2636-25-1- Standard SMILES
CSc1ccc(OP(C)(C)=S)cc1C- InChIKey
IMWZFUZAMUZWAA-UHFFFAOYSA-N- Molecular formula
- C10H15OPS2
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.03019444
Names & identifiers
- Preferred name
- Phosphinothioic acid, dimethyl-, O-(3-methyl-4-(methylthio)phenyl) ester
- IUPAC
- dimethyl-(3-methyl-4-methylsulfanylphenoxy)-sulfanylidene-λ5-phosphane
Names & synonyms
Bayer 34098BRN 24485202636-25-1ENT 25,609Phosphinothioic acid, dimethyl-, O-(3-methyl-4-(methylthio)phenyl) esterO-(3-Methyl-4-(methylthio)phenyl) dimethylphosphinothioateDTXSID10180963RefChem:370301DTXCID50103454O-[3-methyl-4-(methylsulfanyl)phenyl] dimethylphosphinothioate
Database identifiers
- CAS
2636-25-1- PubChem CID
- 200746
- DTXSID
DTXSID10180963
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
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Compound notes
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