2-(Ethylthio)ethylamine

C₄H₁₁NSCAS 36489-03-9105.20 g/mol

Open in Covalent MOL file

Primary amine Sulfide

Properties

Molecular formula: C₄H₁₁NS
Molar mass: 105.20 g/mol
Exact mass: 105.0612 Da
logP: 0.70Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 2
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

36489-03-9

SMILES

CCSCCN

InChIKey

HJCTVUWPHAZTLI-UHFFFAOYSA-N

InChI

InChI=1S/C4H11NS/c1-2-6-4-3-5/h2-5H2,1H3

Weigh it out

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

Names and synonyms

1 names

Ethanamine, 2-(ethylthio)-

Work with 2-(Ethylthio)ethylamine

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′-Thiobis[ethanamine]871-76-159 % similar Ethyl propyl sulfide4110-50-350 % similar Diethyl sulfide352-93-247 % similar 2-(Ethylthio)ethanol110-77-045 % similar 2-Chloroethyl ethyl sulfide693-07-245 % similar 2-Methylthioethylamine18542-42-243 % similar Cystamine dihydrochloride56-17-736 % similar Propylamine107-10-835 % similar

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

Same formula

3-(Methylthio)propylamine4104-45-4

Elsewhere

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