methylsulfinothioylmethanolate

C2H5OS2- — CID 140800448

IUPACmethylsulfinothioylmethanolate
SMILESCS(=S)C[O-]
InChIInChI=1S/C2H5OS2/c1-5(4)2-3/h2H2,1H3/q-1
InChIKeyQSKMFSGJXKSROH-UHFFFAOYSA-N
MW109.19 g/mol
LogP-0.99
Rot. Bonds1

About methylsulfinothioylmethanolate

methylsulfinothioylmethanolate (PubChem CID 140800448) has the molecular formula C2H5OS2- and a molecular weight of 109.19 g/mol. Its IUPAC name is methylsulfinothioylmethanolate.

Molecular Properties

Compound Namemethylsulfinothioylmethanolate
PubChem CID140800448
Molecular FormulaC2H5OS2-
Molecular Weight109.19 g/mol
Exact Mass108.98
IUPAC Namemethylsulfinothioylmethanolate
SMILESCS(=S)C[O-]
InChIInChI=1S/C2H5OS2/c1-5(4)2-3/h2H2,1H3/q-1
InChIKeyQSKMFSGJXKSROH-UHFFFAOYSA-N
XLogP-0.99
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.19
LogP ≤ 5-0.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze methylsulfinothioylmethanolate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl-iodo-sulfanylidene-λ4-sulfane
CID 89315007
methyl-sulfanylidene-(2,2,3,3-tetramethylbutyl)-λ4-sulfane
CID 134528992
erbium(3+);ethanolate
CID 14029842
ethanolate;niobium
CID 18534493
CID 159434150
CID 159434150
potassium ethanolate
CID 23670592
ethanolate;vanadium(2+)
CID 160956004
[ethyl(sulfanylidene)-λ6-sulfanylidyne]borane
CID 89345371
2-methyl-3-methylsulfinylprop-1-ene
CID 89314117
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl-methyl-sulfanylidene-λ4-sulfane
CID 126510344
heptamagnesium;ethanolate;dichloride
CID 173366879
2-methylbutyl-oxido-sulfanylidene-λ4-sulfane
CID 89374363

Frequently Asked Questions

What is the IUPAC name of methylsulfinothioylmethanolate?
The IUPAC name of methylsulfinothioylmethanolate (CID 140800448) is methylsulfinothioylmethanolate.
What is the SMILES notation for methylsulfinothioylmethanolate?
The canonical SMILES for methylsulfinothioylmethanolate is CS(=S)C[O-].
What is the InChIKey of methylsulfinothioylmethanolate?
The InChIKey is QSKMFSGJXKSROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5OS2/c1-5(4)2-3/h2H2,1H3/q-1.
What are the key properties of methylsulfinothioylmethanolate?
methylsulfinothioylmethanolate has a molecular weight of 109.19 g/mol, XLogP of -0.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfinothioylmethanolate is sourced from PubChem (CID 140800448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).