hydroxy-methoxy-dimethyl-λ4-sulfane

C3H10O2S — CID 21017922

IUPAChydroxy-methoxy-dimethyl-λ4-sulfane
SMILESCOS(C)(C)O
InChIInChI=1S/C3H10O2S/c1-5-6(2,3)4/h4H,1-3H3
InChIKeyIYXZDPYMZQXZPU-UHFFFAOYSA-N
MW110.18 g/mol
LogP1.09
Rot. Bonds1

About hydroxy-methoxy-dimethyl-λ4-sulfane

hydroxy-methoxy-dimethyl-λ4-sulfane (PubChem CID 21017922) has the molecular formula C3H10O2S and a molecular weight of 110.18 g/mol. Its IUPAC name is hydroxy-methoxy-dimethyl-λ4-sulfane.

Molecular Properties

Compound Namehydroxy-methoxy-dimethyl-λ4-sulfane
PubChem CID21017922
Molecular FormulaC3H10O2S
Molecular Weight110.18 g/mol
Exact Mass110.04
IUPAC Namehydroxy-methoxy-dimethyl-λ4-sulfane
SMILESCOS(C)(C)O
InChIInChI=1S/C3H10O2S/c1-5-6(2,3)4/h4H,1-3H3
InChIKeyIYXZDPYMZQXZPU-UHFFFAOYSA-N
XLogP1.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.18
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydroxy-methoxy-dimethyl-λ4-sulfane?
The IUPAC name of hydroxy-methoxy-dimethyl-λ4-sulfane (CID 21017922) is hydroxy-methoxy-dimethyl-λ4-sulfane.
What is the SMILES notation for hydroxy-methoxy-dimethyl-λ4-sulfane?
The canonical SMILES for hydroxy-methoxy-dimethyl-λ4-sulfane is COS(C)(C)O.
What is the InChIKey of hydroxy-methoxy-dimethyl-λ4-sulfane?
The InChIKey is IYXZDPYMZQXZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10O2S/c1-5-6(2,3)4/h4H,1-3H3.
What are the key properties of hydroxy-methoxy-dimethyl-λ4-sulfane?
hydroxy-methoxy-dimethyl-λ4-sulfane has a molecular weight of 110.18 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-methoxy-dimethyl-λ4-sulfane is sourced from PubChem (CID 21017922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).