Carbamic acid, N-(O,O-dimethylphosphorothioyl)-N-methyl-, o-isopropoxyphenyl ester
Basic information
- CAS
28789-76-6- Standard SMILES
COP(=S)(OC)N(C)C(=O)Oc1ccccc1OC(C)C- InChIKey
MLSUSBOUXRLKFF-UHFFFAOYSA-N- Molecular formula
- C13H20NO5PS
- Average molar mass
- 333.34 g/mol
- Monoisotopic mass
- 333.07998091
Names & identifiers
- Preferred name
- Carbamic acid, N-(O,O-dimethylphosphorothioyl)-N-methyl-, o-isopropoxyphenyl ester
- IUPAC
- (2-propan-2-yloxyphenyl) N-dimethoxyphosphinothioyl-N-methylcarbamate
- English name
- N-(Dimethoxyphosphinothioyl)-N-methylcarbamic acid o-isopropoxyphenyl ester
- Molecular weight
- 0
Names & synonyms
BRN 200800728789-76-6Carbamic acid, N-(O,O-dimethylphosphorothioyl)-N-methyl-, o-isopropoxyphenyl esterDTXSID10182967o-Isopropoxyphenyl N-(O,O-dimethylphosphorothioyl)-N-methylcarbamateN-(Dimethylphosphorothioyl)-N-methylcarbamic acid, o-isopropoxyphenyl esterRefChem:332678DTXCID501054582-[(Propan-2-yl)oxy]phenyl (dimethoxyphosphorothioyl)(methyl)carbamateN-(Dimethoxyphosphinothioyl)-N-methylcarbamic acid o-isopropoxyphenyl ester
Database identifiers
- CAS
28789-76-6- PubChem CID
- 34332
- DTXSID
DTXSID10182967- Nikkaji
- J42.892B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 385
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Related reactions
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Compound notes
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