methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane

C2H6O2S2 — CID 14573333

IUPACmethoxy-methyl-oxo-sulfanylidene-lambda6-sulfane
SMILESCOS(C)(=O)=S
InChIInChI=1S/C2H6O2S2/c1-4-6(2,3)5/h1-2H3
InChIKeyLEBYISUPSSNHTJ-UHFFFAOYSA-N
MW126.20 g/mol
LogP-0.08
Rot. Bonds1

About methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane

methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane (PubChem CID 14573333) has the molecular formula C2H6O2S2 and a molecular weight of 126.20 g/mol. Its IUPAC name is methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane.

Molecular Properties

Compound Namemethoxy-methyl-oxo-sulfanylidene-lambda6-sulfane
PubChem CID14573333
Molecular FormulaC2H6O2S2
Molecular Weight126.20 g/mol
Exact Mass125.98
IUPAC Namemethoxy-methyl-oxo-sulfanylidene-lambda6-sulfane
SMILESCOS(C)(=O)=S
InChIInChI=1S/C2H6O2S2/c1-4-6(2,3)5/h1-2H3
InChIKeyLEBYISUPSSNHTJ-UHFFFAOYSA-N
XLogP-0.08
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 5-0.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane?
The IUPAC name of methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane (CID 14573333) is methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane.
What is the SMILES notation for methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane?
The canonical SMILES for methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane is COS(C)(=O)=S.
What is the InChIKey of methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane?
The InChIKey is LEBYISUPSSNHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O2S2/c1-4-6(2,3)5/h1-2H3.
What are the key properties of methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane?
methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane has a molecular weight of 126.20 g/mol, XLogP of -0.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-methyl-oxo-sulfanylidene-lambda6-sulfane is sourced from PubChem (CID 14573333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).