ethoxyethane;methylsulfinylmethane

C6H16O2S — CID 19869614

IUPACethoxyethane;methylsulfinylmethane
SMILESCCOCC.CS(C)=O
InChIInChI=1S/C4H10O.C2H6OS/c1-3-5-4-2;1-4(2)3/h3-4H2,1-2H3;1-2H3
InChIKeyJJTJZFLRKYYGGS-UHFFFAOYSA-N
MW152.26 g/mol
LogP1.04
Rot. Bonds2

About ethoxyethane;methylsulfinylmethane

ethoxyethane;methylsulfinylmethane (PubChem CID 19869614) has the molecular formula C6H16O2S and a molecular weight of 152.26 g/mol. Its IUPAC name is ethoxyethane;methylsulfinylmethane.

Molecular Properties

Compound Nameethoxyethane;methylsulfinylmethane
PubChem CID19869614
Molecular FormulaC6H16O2S
Molecular Weight152.26 g/mol
Exact Mass152.09
IUPAC Nameethoxyethane;methylsulfinylmethane
SMILESCCOCC.CS(C)=O
InChIInChI=1S/C4H10O.C2H6OS/c1-3-5-4-2;1-4(2)3/h3-4H2,1-2H3;1-2H3
InChIKeyJJTJZFLRKYYGGS-UHFFFAOYSA-N
XLogP1.04
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.26
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethoxyethane;oxophosphane
CID 18547249
ethoxyethane;formaldehyde
CID 174286087
ethoxyethane;hydrate
CID 22594236
ethoxyethane;sulfane
CID 90240371
ethoxyethane;sulfane
CID 87243372
ethoxyethane;pentahydrate
CID 141041283
disodium;ethoxyethane
CID 23107014
CID 135083812
CID 135083812
ethoxyethane;molybdenum;tetrahydrochloride
CID 174873486
aluminum;ethoxyethane;triiodide
CID 173390625

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;methylsulfinylmethane?
The IUPAC name of ethoxyethane;methylsulfinylmethane (CID 19869614) is ethoxyethane;methylsulfinylmethane.
What is the SMILES notation for ethoxyethane;methylsulfinylmethane?
The canonical SMILES for ethoxyethane;methylsulfinylmethane is CCOCC.CS(C)=O.
What is the InChIKey of ethoxyethane;methylsulfinylmethane?
The InChIKey is JJTJZFLRKYYGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C2H6OS/c1-3-5-4-2;1-4(2)3/h3-4H2,1-2H3;1-2H3.
What are the key properties of ethoxyethane;methylsulfinylmethane?
ethoxyethane;methylsulfinylmethane has a molecular weight of 152.26 g/mol, XLogP of 1.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;methylsulfinylmethane is sourced from PubChem (CID 19869614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).