Trimethyloxosulphonium chloride

C₃H₉ClOSCAS 5034-06-0128.61 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₉ClOS
Molar mass: 128.61 g/mol
Exact mass: 128.0063 Da
Melting point: 215–216 °C
logP: -2.62Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation88% of notifiers
H319 Causes serious eye irritation88% of notifiers
H335 May cause respiratory irritation86% of notifiers

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

5034-06-0

SMILES

C[S+](C)(C)=O.[Cl-]

InChIKey

KQYWHJICYXXDSQ-UHFFFAOYSA-M

InChI

InChI=1S/C3H9OS.ClH/c1-5(2,3)4;/h1-3H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

5 names

Sulfoxonium, trimethyl-, chloride
Trimethylsulfonium chloride, oxide
Trimethyloxosulfonium chloride
Trimethylsulfoxonium chloride
NSC 221182

Work with Trimethyloxosulphonium chloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Trimethylsulfoxonium iodide1774-47-6Salt Trimethylsulfoxonium bromide25596-24-1Salt

Elsewhere

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