1-[(S)-ethenylsulfinyl]ethane

C4H8OS — CID 15938994

IUPAC1-[(S)-ethenylsulfinyl]ethane
SMILESC=C[S@@](=O)CC
InChIInChI=1S/C4H8OS/c1-3-6(5)4-2/h3H,1,4H2,2H3/t6-/m1/s1
InChIKeyHNXMKNMCALMEPP-ZCFIWIBFSA-N
MW104.17 g/mol
LogP0.90
Rot. Bonds2

About 1-[(S)-ethenylsulfinyl]ethane

1-[(S)-ethenylsulfinyl]ethane (PubChem CID 15938994) has the molecular formula C4H8OS and a molecular weight of 104.17 g/mol. Its IUPAC name is 1-[(S)-ethenylsulfinyl]ethane.

Molecular Properties

Compound Name1-[(S)-ethenylsulfinyl]ethane
PubChem CID15938994
Molecular FormulaC4H8OS
Molecular Weight104.17 g/mol
Exact Mass104.03
IUPAC Name1-[(S)-ethenylsulfinyl]ethane
SMILESC=C[S@@](=O)CC
InChIInChI=1S/C4H8OS/c1-3-6(5)4-2/h3H,1,4H2,2H3/t6-/m1/s1
InChIKeyHNXMKNMCALMEPP-ZCFIWIBFSA-N
XLogP0.90
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.17
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(S)-ethenylsulfinyl]ethane?
The IUPAC name of 1-[(S)-ethenylsulfinyl]ethane (CID 15938994) is 1-[(S)-ethenylsulfinyl]ethane.
What is the SMILES notation for 1-[(S)-ethenylsulfinyl]ethane?
The canonical SMILES for 1-[(S)-ethenylsulfinyl]ethane is C=C[S@@](=O)CC.
What is the InChIKey of 1-[(S)-ethenylsulfinyl]ethane?
The InChIKey is HNXMKNMCALMEPP-ZCFIWIBFSA-N. The full InChI is InChI=1S/C4H8OS/c1-3-6(5)4-2/h3H,1,4H2,2H3/t6-/m1/s1.
What are the key properties of 1-[(S)-ethenylsulfinyl]ethane?
1-[(S)-ethenylsulfinyl]ethane has a molecular weight of 104.17 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(S)-ethenylsulfinyl]ethane is sourced from PubChem (CID 15938994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).