Methanesulfinyl chloride

CH₃ClOSCAS 676-85-798.54 g/mol

Open in Covalent MOL file

Properties

Molecular formula: CH₃ClOS
Molar mass: 98.54 g/mol
Exact mass: 97.9593 Da
logP: 0.52Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

676-85-7

SMILES

CS(=O)Cl

InChIKey

LURSUHVHQZXABT-UHFFFAOYSA-N

InChI

InChI=1S/CH3ClOS/c1-4(2)3/h1H3

Weigh it out

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

Names and synonyms

4 names

Methansulfinylchlorid
Methylsulphinyl chloride
Methanesulphinyl chloride
Methane sulfinyl chloride

Reactions

Methanesulfinyl chloride (Method I)product

Work with Methanesulfinyl 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

Similar compounds

Dimethyl sulfoxide67-68-531 % similar Thionyl chloride7719-09-731 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook