Fosmethilan
Basic information
- CAS
83733-82-8- Standard SMILES
CCCC(=O)N(CSP(=S)(OC)OC)c1ccccc1Cl- InChIKey
MVBGKYGTNGPFHT-UHFFFAOYSA-N- Molecular formula
- C13H19ClNO3PS2
- Average molar mass
- 367.9 g/mol
- Monoisotopic mass
- 367.0232505
Overview
Fosmethilan is an anilide.
Names & identifiers
- Preferred name
- Fosmethilan
- IUPAC
- N-(2-chlorophenyl)-N-(dimethoxyphosphinothioylsulfanylmethyl)butanamide
- English name
- FOSMETHILAN
- Molecular formula
- C13H19ClNO3PS2
- Molecular weight
- 367.85
Names & synonyms
FosmethilanNevifosPHOSMETHYLANNevifos 5083733-82-8XZ89HR4NLXNE-79168DTXSID0058196Phosphorodithioic acid, S-(((2-chlorophenyl)(1-oxobutyl)amino)methyl) O,O-dimethyl esterO,O-dimethyl-S-(N-((2-chlorophenyl)butyramido)methyl)dithiophosphateRefChem:141392DTXCID6031964
Show more names
Nevifos-50Neviki-79168N-(2-chlorophenyl)-N-(dimethoxyphosphinothioylsulfanylmethyl)butanamid ePhosphorodithioic acid, S-[[(2-chlorophenyl)(1-oxobutyl)amino]methyl] O,O-dimethyl ester
Fosmethilan [ISO]NE 79168FosmetilanN-(2-chlorophenyl)-N-(dimethoxyphosphinothioylsulfanylmethyl)butanamideNevifosz 50 ECNeviki 79168BRN 5111838UNII-XZ89HR4NLX
Database identifiers
- CAS
83733-82-8- PubChem CID
- 55138
- DTXSID
DTXSID0058196- ChEBI
CHEBI:82127- UNII
- XZ89HR4NLX
- Nikkaji
- J228.109K
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Physicochemical properties
- Boiling point
- 456.9 · 456.9±55.0 °C(Predicted)
- Density
- 1.324 · 1.324±0.06 g/cm3(Predicted)
- pka
- -0.92 · -0.92±0.50(Predicted)
- FDA UNII
- 89 HR4NLX · XZ89HR4NLX
Chemistry & industry
Additional notes
DefinitionChEBI: Fosmethilan is an anilide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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