chempirical

4-(3-Hydroxypropyl)thiomorpholine 1,1-dioxide

C7H15NO3SCAS 205194-33-8193.26 g/mol

Open in Covalent MOL file
SOONHO
AlcoholSulfoneTertiary amine

Properties

Molecular formula
C7H15NO3S
Molar mass
193.26 g/mol
Exact mass
193.0773 Da
logP
-0.90Crippen estimate
Polar surface area
57.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

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
205194-33-8
SMILES
C1CS(=O)(=O)CCN1CCCO
InChIKey
VAJSFWFPXNWBLF-UHFFFAOYSA-N
InChI
InChI=1S/C7H15NO3S/c9-5-1-2-8-3-6-12(10,11)7-4-8/h9H,1-7H2

Weigh it out

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

Work with 4-(3-Hydroxypropyl)thiomorpholine 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-Hydroxyethyl)thiomorpholine 1,1-dioxide26475-62-775 % similar 4-(3-Aminopropyl)thiomorpholine 1,1-dioxide90000-25-257 % similar 1-Pyrrolidinepropanol19748-66-457 % similar 1-Piperidinepropanol104-58-554 % similar 4-(2-Aminoethyl)thiomorpholine 1,1-dioxide89937-52-050 % similar Hepps (buffer)16052-06-547 % similar N,N-Bis(2-hydroxyethyl)-2-aminoethanesulfonic acid10191-18-147 % similar 3-Morpholino-1-propanol4441-30-946 % similar

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

Elsewhere

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