2-Methoxy-1-ethanesulfonyl chloride

C₃H₇ClO₃SCAS 51517-01-2158.60 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₇ClO₃S
Molar mass: 158.60 g/mol
Exact mass: 157.9804 Da
logP: 0.20Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 3

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, P501

Identifiers

CAS number

51517-01-2

SMILES

COCCS(=O)(=O)Cl

InChIKey

DUNNNVSEUCJEOY-UHFFFAOYSA-N

InChI

InChI=1S/C3H7ClO3S/c1-7-2-3-8(4,5)6/h2-3H2,1H3

Weigh it out

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

Names and synonyms

1 name

2-Methoxyethane-1-sulfonyl chloride

Work with 2-Methoxy-1-ethanesulfonyl 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

Propanesulfonyl chloride10147-36-148 % similar Butanesulfonyl chloride2386-60-944 % similar 2-Chloroethanesulfonyl chloride1622-32-844 % similar 2-(Trimethylsilyl)ethane-1-sulfonyl chloride106018-85-343 % similar 1-Hexadecanesulfonyl chloride38775-38-141 % similar 1-Octanesulfonyl chloride7795-95-141 % similar 3-Chloropropanesulfonyl chloride1633-82-541 % similar Ethanesulfonyl chloride594-44-540 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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