1-ethenyl-3-ethenylsulfonylbenzene

C10H10O2S — CID 21019423

IUPAC1-ethenyl-3-ethenylsulfonylbenzene
SMILESC=Cc1cccc(S(=O)(=O)C=C)c1
InChIInChI=1S/C10H10O2S/c1-3-9-6-5-7-10(8-9)13(11,12)4-2/h3-8H,1-2H2
InChIKeyQEVCNAKWYCQSOD-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.25
Rot. Bonds3

About 1-ethenyl-3-ethenylsulfonylbenzene

1-ethenyl-3-ethenylsulfonylbenzene (PubChem CID 21019423) has the molecular formula C10H10O2S and a molecular weight of 194.25 g/mol. Its IUPAC name is 1-ethenyl-3-ethenylsulfonylbenzene.

Molecular Properties

Compound Name1-ethenyl-3-ethenylsulfonylbenzene
PubChem CID21019423
Molecular FormulaC10H10O2S
Molecular Weight194.25 g/mol
Exact Mass194.04
IUPAC Name1-ethenyl-3-ethenylsulfonylbenzene
SMILESC=Cc1cccc(S(=O)(=O)C=C)c1
InChIInChI=1S/C10H10O2S/c1-3-9-6-5-7-10(8-9)13(11,12)4-2/h3-8H,1-2H2
InChIKeyQEVCNAKWYCQSOD-UHFFFAOYSA-N
XLogP2.25
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3-ethenylsulfonylbenzene?
The IUPAC name of 1-ethenyl-3-ethenylsulfonylbenzene (CID 21019423) is 1-ethenyl-3-ethenylsulfonylbenzene.
What is the SMILES notation for 1-ethenyl-3-ethenylsulfonylbenzene?
The canonical SMILES for 1-ethenyl-3-ethenylsulfonylbenzene is C=Cc1cccc(S(=O)(=O)C=C)c1.
What is the InChIKey of 1-ethenyl-3-ethenylsulfonylbenzene?
The InChIKey is QEVCNAKWYCQSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2S/c1-3-9-6-5-7-10(8-9)13(11,12)4-2/h3-8H,1-2H2.
What are the key properties of 1-ethenyl-3-ethenylsulfonylbenzene?
1-ethenyl-3-ethenylsulfonylbenzene has a molecular weight of 194.25 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-ethenylsulfonylbenzene is sourced from PubChem (CID 21019423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).