2-(2-Chloroethoxy)benzene-1-sulfonamide

C₈H₁₀ClNO₃SCAS 82097-01-6235.68 g/mol

Open in Covalent MOL file

Alkyl halide Ether Sulfonamide

Properties

Molecular formula: C₈H₁₀ClNO₃S
Molar mass: 235.68 g/mol
Exact mass: 235.0070 Da
logP: 0.95Crippen estimate
Polar surface area: 69.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

82097-01-6

SMILES

C1=CC=C(C(=C1)OCCCl)S(=O)(=O)N

InChIKey

WAJIUYJWAGLDAC-UHFFFAOYSA-N

InChI

InChI=1S/C8H10ClNO3S/c9-5-6-13-7-3-1-2-4-8(7)14(10,11)12/h1-4H,5-6H2,(H2,10,11,12)

Weigh it out

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

Names and synonyms

1 names

2-(2-Chloroethoxy)-benzenesulfonamide

Work with 2-(2-Chloroethoxy)benzene-1-sulfonamide

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-(2-Methoxyethoxy)benzenesulfonamide82031-33-266 % similar 2-(Trifluoromethoxy)benzenesulfonamide37526-59-350 % similar 2-Bromobenzenesulfonamide92748-09-947 % similar 2-Chlorobenzenesulfonamide6961-82-646 % similar 2-Aminobenzenesulfonamide3306-62-543 % similar 2-Fluorobenzenesulfonamide30058-40-342 % similar 2-Methylbenzenesulfonamide88-19-742 % similar (2-Chloroethoxy)benzene622-86-642 % similar

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

Elsewhere

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