cyclopentene;1-ethenylsulfonylethene

C9H14O2S — CID 69053806

IUPACcyclopentene;1-ethenylsulfonylethene
SMILESC1=CCCC1.C=CS(=O)(=O)C=C
InChIInChI=1S/C5H8.C4H6O2S/c1-2-4-5-3-1;1-3-7(5,6)4-2/h1-2H,3-5H2;3-4H,1-2H2
InChIKeyKMIVNQFKMYOHAC-UHFFFAOYSA-N
MW186.28 g/mol
LogP2.41
Rot. Bonds2

About cyclopentene;1-ethenylsulfonylethene

cyclopentene;1-ethenylsulfonylethene (PubChem CID 69053806) has the molecular formula C9H14O2S and a molecular weight of 186.28 g/mol. Its IUPAC name is cyclopentene;1-ethenylsulfonylethene.

Molecular Properties

Compound Namecyclopentene;1-ethenylsulfonylethene
PubChem CID69053806
Molecular FormulaC9H14O2S
Molecular Weight186.28 g/mol
Exact Mass186.07
IUPAC Namecyclopentene;1-ethenylsulfonylethene
SMILESC1=CCCC1.C=CS(=O)(=O)C=C
InChIInChI=1S/C5H8.C4H6O2S/c1-2-4-5-3-1;1-3-7(5,6)4-2/h1-2H,3-5H2;3-4H,1-2H2
InChIKeyKMIVNQFKMYOHAC-UHFFFAOYSA-N
XLogP2.41
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclopentene;1-ethenylsulfonylethene?
The IUPAC name of cyclopentene;1-ethenylsulfonylethene (CID 69053806) is cyclopentene;1-ethenylsulfonylethene.
What is the SMILES notation for cyclopentene;1-ethenylsulfonylethene?
The canonical SMILES for cyclopentene;1-ethenylsulfonylethene is C1=CCCC1.C=CS(=O)(=O)C=C.
What is the InChIKey of cyclopentene;1-ethenylsulfonylethene?
The InChIKey is KMIVNQFKMYOHAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8.C4H6O2S/c1-2-4-5-3-1;1-3-7(5,6)4-2/h1-2H,3-5H2;3-4H,1-2H2.
What are the key properties of cyclopentene;1-ethenylsulfonylethene?
cyclopentene;1-ethenylsulfonylethene has a molecular weight of 186.28 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentene;1-ethenylsulfonylethene is sourced from PubChem (CID 69053806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).