chempirical

Sodium ethanethiolate

C2H5NaSCAS 811-51-884.11 g/mol

Open in Covalent MOL file
S−Na+

Properties

Molecular formula
C2H5NaS
Molar mass
84.11 g/mol
Exact mass
84.0010 Da
logP
-2.44Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 1
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
811-51-8
SMILES
CC[S-].[Na+]
InChIKey
QJDUDPQVDAASMV-UHFFFAOYSA-M
InChI
InChI=1S/C2H6S.Na/c1-2-3;/h3H,2H2,1H3;/q;+1/p-1

Weigh it out

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

Work with Sodium ethanethiolate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Ethanethiol75-08-1Parent compound

Similar compounds

Sodium ethoxide141-52-633 % similar Sodium tetraethylborate15523-24-733 % similar Sodium methanethiolate5188-07-831 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook