2-ethenylsulfinyl-2-methylpropane

C6H12OS — CID 534766

IUPAC2-ethenylsulfinyl-2-methylpropane
SMILESC=CS(=O)C(C)(C)C
InChIInChI=1S/C6H12OS/c1-5-8(7)6(2,3)4/h5H,1H2,2-4H3
InChIKeyRKIAVFMRPCYSHY-UHFFFAOYSA-N
MW132.23 g/mol
LogP1.68
Rot. Bonds1

About 2-ethenylsulfinyl-2-methylpropane

2-ethenylsulfinyl-2-methylpropane (PubChem CID 534766) has the molecular formula C6H12OS and a molecular weight of 132.23 g/mol. Its IUPAC name is 2-ethenylsulfinyl-2-methylpropane.

Molecular Properties

Compound Name2-ethenylsulfinyl-2-methylpropane
PubChem CID534766
Molecular FormulaC6H12OS
Molecular Weight132.23 g/mol
Exact Mass132.06
IUPAC Name2-ethenylsulfinyl-2-methylpropane
SMILESC=CS(=O)C(C)(C)C
InChIInChI=1S/C6H12OS/c1-5-8(7)6(2,3)4/h5H,1H2,2-4H3
InChIKeyRKIAVFMRPCYSHY-UHFFFAOYSA-N
XLogP1.68
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.23
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(Ethenesulfonyl)-2-methylpropane
CID 5323639
Propane, 1-(ethenylsulfinyl)-
CID 143855
Vinyl ethyl sulfoxide
CID 182087
Allyl methyl sulfoxide
CID 10887844
Butane, 1-(ethenylsulfinyl)-
CID 12174977
Propane, 2-(ethenylsulfinyl)-
CID 5323637
2-Ethenylsulfonylpropane
CID 5323638
t-Butylthioethyl vinyl sulfoxide
CID 12418610
1-(Ethanesulfinyl)propadiene
CID 12431680
2-Methyl-2-prop-2-enylsulfinylpropane
CID 13701472
(R)-2-Methyl-2-(vinylsulfinyl)propane
CID 14434779
2-methyl-2-[(E)-prop-1-enyl]sulfinylpropane
CID 15644957

Frequently Asked Questions

What is the IUPAC name of 2-ethenylsulfinyl-2-methylpropane?
The IUPAC name of 2-ethenylsulfinyl-2-methylpropane (CID 534766) is 2-ethenylsulfinyl-2-methylpropane.
What is the SMILES notation for 2-ethenylsulfinyl-2-methylpropane?
The canonical SMILES for 2-ethenylsulfinyl-2-methylpropane is C=CS(=O)C(C)(C)C.
What is the InChIKey of 2-ethenylsulfinyl-2-methylpropane?
The InChIKey is RKIAVFMRPCYSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OS/c1-5-8(7)6(2,3)4/h5H,1H2,2-4H3.
What are the key properties of 2-ethenylsulfinyl-2-methylpropane?
2-ethenylsulfinyl-2-methylpropane has a molecular weight of 132.23 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylsulfinyl-2-methylpropane is sourced from PubChem (CID 534766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).