4-Aminothiomorpholine 1,1-dioxide

C₄H₁₀N₂O₂SCAS 26494-76-8150.20 g/mol

Open in Covalent MOL file

Primary amine Sulfone Tertiary amine

Properties

Molecular formula: C₄H₁₀N₂O₂S
Molar mass: 150.20 g/mol
Exact mass: 150.0463 Da
logP: -1.41Crippen estimate
Polar surface area: 63.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 0

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

26494-76-8

SMILES

C1CS(=O)(=O)CCN1N

InChIKey

YDKNASMIEZGJEJ-UHFFFAOYSA-N

InChI

InChI=1S/C4H10N2O2S/c5-6-1-3-9(7,8)4-2-6/h1-5H2

Weigh it out

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

Work with 4-Aminothiomorpholine 1,1-dioxide

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

4-(2-Aminoethyl)thiomorpholine 1,1-dioxide89937-52-048 % similar 4-(3-Hydroxypropyl)thiomorpholine 1,1-dioxide205194-33-844 % similar 4-(3-Aminopropyl)thiomorpholine 1,1-dioxide90000-25-244 % similar 4-(2-Hydroxyethyl)thiomorpholine 1,1-dioxide26475-62-742 % similar Sulfolane126-33-040 % similar 1-Aminopyrrolidine16596-41-140 % similar 4-Propargylthiomorpholine 1,1-dioxide10442-03-239 % similar 4-(4-Aminophenyl)thiomorpholine 1,1-dioxide105297-10-739 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook