Basic information
- CAS
35335-60-5- Standard SMILES
CCP(N)(=S)Oc1ccc(SC)c(C)c1- InChIKey
LIIJBBWJAXDFKA-UHFFFAOYSA-N- Molecular formula
- C10H16NOPS2
- Average molar mass
- 261.3 g/mol
- Monoisotopic mass
- 261.04109348
Names & identifiers
- Preferred name
- Phosphonamidothioic acid, ethyl-, 4-(methylthio)-m-tolyl ester
- IUPAC
- 4-[amino(ethyl)phosphinothioyl]oxy-2-methyl-1-methylsulfanylbenzene
Names & synonyms
BAY hol 0574Ethylphosphonamidothionic acid 4-(methylthio)-m-tolyl esterPhosphonamidothioic acid, ethyl-, 4-(methylthio)-m-tolyl ester35335-60-5RefChem:370347DTXSID50956765O-[3-Methyl-4-(methylsulfanyl)phenyl] P-ethylphosphonamidothioate
Database identifiers
- CAS
35335-60-5- PubChem CID
- 198151
- DTXSID
DTXSID50956765
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 92.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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