chempirical

Terbufos

C9H21O2PS3CAS 13071-79-9288.42 g/mol

Open in Covalent MOL file
OPSOSS
Sulfide

Properties

Molecular formula
C9H21O2PS3
Molar mass
288.42 g/mol
Exact mass
288.0441 Da
Density
1.105 g/mL (at 24 °C)
Melting point
−29 °C
Boiling point
69 °C (at 0.01 Torr)
logP
4.51Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
7

Identifiers

CAS number
13071-79-9
SMILES
CCOP(=S)(OCC)SCSC(C)(C)C
InChIKey
XLNZEKHULJKQBA-UHFFFAOYSA-N
InChI
InChI=1S/C9H21O2PS3/c1-6-10-12(13,11-7-2)15-8-14-9(3,4)5/h6-8H2,1-5H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

12 names
  • Phosphorodithioic acid, S-[[(1,1-dimethylethyl)thio]methyl] O,O-diethyl ester
  • Phosphorodithioic acid, S-[(tert-butylthio)methyl] O,O-diethyl ester
  • Methanethiol, (tert-butylthio)-, S-ester with O,O-diethyl phosphorodithioate
  • O,O-Diethyl S-(tert-butylthio)methyl phosphorodithioate
  • Counter
  • AC 92100
  • S-[(tert-Butylthio)methyl] O,O-diethyl phosphorodithioate
  • Counter 15G
  • O,O-Diethyl S-[[(1,1-dimethylethyl)thio]methyl] phosphorodithioate
  • Cyanater
  • Terbuphos
  • Terbutifos

Work with Terbufos

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethion563-12-268 % similar Phorate298-02-258 % similar Chlormephos24934-91-652 % similar Disulfoton298-04-447 % similar Carbophenothion786-19-645 % similar Dioxathion78-34-241 % similar Prothoate2275-18-539 % similar Mecarbam2595-54-236 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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