Cyclopropanesulfonyl chloride

C₃H₅ClO₂SCAS 139631-62-2140.58 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₅ClO₂S
Molar mass: 140.58 g/mol
Exact mass: 139.9699 Da
logP: 0.72Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 53 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number

139631-62-2

SMILES

C1CC1S(=O)(=O)Cl

InChIKey

PFWWSGFPICCWGU-UHFFFAOYSA-N

InChI

InChI=1S/C3H5ClO2S/c4-7(5,6)3-1-2-3/h3H,1-2H2

Weigh it out

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

Work with Cyclopropanesulfonyl 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

2-Propanesulfonyl chloride10147-37-243 % similar 1,1-Dimethylethyl 4-(chlorosulfonyl)-1-piperidinecarboxylate782501-25-140 % similar Cyclopropanesulfonamide154350-29-536 % similar N-Benzyloxycarbonyl-4-piperidinesulfonyl chloride287953-54-235 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook