Triphenylphosphine sulfide

C18H15PSCAS 3878-45-3294.35 g/mol

Open in Covalent MOL file
SP

Properties

Molecular formula
C18H15PS
Molar mass
294.35 g/mol
Exact mass
294.0632 Da
Density
1.246 g/mL (at 20 °C)
Melting point
161 °C
logP
3.44Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 81 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
3878-45-3
SMILES
S=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
VYNGFCUGSYEOOZ-UHFFFAOYSA-N
InChI
InChI=1S/C18H15PS/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H

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Names and synonyms

5 names
  • Phosphine sulfide, triphenyl-
  • Triphenylphosphine monosulfide
  • NSC 62216
  • Triphenyl(thioxo)phosphine
  • Triphenylphophine sulfide

Work with Triphenylphosphine sulfide

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

P-Phenylphosphonothioic dichloride3497-00-550 % similar Triphenylphosphine oxide791-28-643 % similar Diphenylphosphinic chloride1499-21-438 % similar Phenylphosphonic acid1571-33-138 % similar Diphenylphosphinic acid1707-03-538 % similar Methyldiphenylphosphine oxide2129-89-738 % similar Dichloromethylidene(triphenyl)-lambda5-phosphane6779-08-438 % similar Phenylphosphonic dichloride824-72-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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