1-(Methylsulfonyl)-2-imidazolidinone

C₄H₈N₂O₃SCAS 41730-79-4164.18 g/mol

Open in Covalent MOL file

Alcohol Sulfone Tertiary Amine

Properties

Molecular formula: C₄H₈N₂O₃S
Molar mass: 164.18 g/mol
Exact mass: 164.0256 Da
Melting point: 192–194 °C
logP: -0.82Crippen estimate
Polar surface area: 70.0 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

41730-79-4

SMILES

CS(=O)(=O)N1CCN=C1O

InChIKey

WTCUHYRXLIHSLY-UHFFFAOYSA-N

InChI

InChI=1S/C4H8N2O3S/c1-10(8,9)6-3-2-5-4(6)7/h2-3H2,1H3,(H,5,7)

Weigh it out

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

Names and synonyms

4 names

2-Imidazolidinone, 1-(methylsulfonyl)-
1-(Methylsulfonyl)-2-imidazolidin-2-one
1-Mesyl-2-imidazolidinone
1-Methanesulfonylimidazolidin-2-one

Work with 1-(Methylsulfonyl)-2-imidazolidinone

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

Elsewhere

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