methyl-oxido-sulfanylidene-λ4-sulfane

CH3OS2- — CID 22741612

IUPACmethyl-oxido-sulfanylidene-λ4-sulfane
SMILESCS([O-])=S
InChIInChI=1S/CH4OS2/c1-4(2)3/h1H3,(H,2,3)/p-1
InChIKeyRCDWLBQABJZFIW-UHFFFAOYSA-M
MW95.17 g/mol
LogP-0.17
Rot. Bonds

About methyl-oxido-sulfanylidene-λ4-sulfane

methyl-oxido-sulfanylidene-λ4-sulfane (PubChem CID 22741612) has the molecular formula CH3OS2- and a molecular weight of 95.17 g/mol. Its IUPAC name is methyl-oxido-sulfanylidene-λ4-sulfane.

Molecular Properties

Compound Namemethyl-oxido-sulfanylidene-λ4-sulfane
PubChem CID22741612
Molecular FormulaCH3OS2-
Molecular Weight95.17 g/mol
Exact Mass94.96
IUPAC Namemethyl-oxido-sulfanylidene-λ4-sulfane
SMILESCS([O-])=S
InChIInChI=1S/CH4OS2/c1-4(2)3/h1H3,(H,2,3)/p-1
InChIKeyRCDWLBQABJZFIW-UHFFFAOYSA-M
XLogP-0.17
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.17
LogP ≤ 5-0.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methyl-oxido-sulfanylidene-λ4-sulfane?
The IUPAC name of methyl-oxido-sulfanylidene-λ4-sulfane (CID 22741612) is methyl-oxido-sulfanylidene-λ4-sulfane.
What is the SMILES notation for methyl-oxido-sulfanylidene-λ4-sulfane?
The canonical SMILES for methyl-oxido-sulfanylidene-λ4-sulfane is CS([O-])=S.
What is the InChIKey of methyl-oxido-sulfanylidene-λ4-sulfane?
The InChIKey is RCDWLBQABJZFIW-UHFFFAOYSA-M. The full InChI is InChI=1S/CH4OS2/c1-4(2)3/h1H3,(H,2,3)/p-1.
What are the key properties of methyl-oxido-sulfanylidene-λ4-sulfane?
methyl-oxido-sulfanylidene-λ4-sulfane has a molecular weight of 95.17 g/mol, XLogP of -0.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-oxido-sulfanylidene-λ4-sulfane is sourced from PubChem (CID 22741612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).