4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide

C8H10OS — CID 142910459

IUPAC4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide
SMILESC=CC1=C(C=C)S(=O)CC1
InChIInChI=1S/C8H10OS/c1-3-7-5-6-10(9)8(7)4-2/h3-4H,1-2,5-6H2
InChIKeyGSYYKNGAPMDDLB-UHFFFAOYSA-N
MW154.23 g/mol
LogP1.76
Rot. Bonds2

About 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide

4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide (PubChem CID 142910459) has the molecular formula C8H10OS and a molecular weight of 154.23 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide.

Molecular Properties

Compound Name4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide
PubChem CID142910459
Molecular FormulaC8H10OS
Molecular Weight154.23 g/mol
Exact Mass154.05
IUPAC Name4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide
SMILESC=CC1=C(C=C)S(=O)CC1
InChIInChI=1S/C8H10OS/c1-3-7-5-6-10(9)8(7)4-2/h3-4H,1-2,5-6H2
InChIKeyGSYYKNGAPMDDLB-UHFFFAOYSA-N
XLogP1.76
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.23
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclopenta[b]thiophenone
CID 129706138
Ethylfurfuryl sulfide
CID 528326
2-[(2E)-penta-2,4-dienyl]-2,5-dihydrothiophene 1,1-dioxide
CID 11019544
Furfuryl 2-methyl-2-propenyl sulfide
CID 528327
Furfuryl 2-propenyl sulfide
CID 528328
Furfuryl propyl sulfide
CID 528330
4-Methyl-5-prop-1-enyl-2,3-dihydrothiophene 1,1-dioxide
CID 6421260
2,3-Ditert-butylthiophene 1-oxide
CID 58913764
4,5,6,7-Tetrahydro-1-benzothiophene 1-oxide
CID 66703941
1-Prop-2-enylsulfinylcyclopentene
CID 67229215
2,7a-Dihydro-1-benzothiophene 1-oxide
CID 67366195
4-Ethenyl-2,5-dimethyl-2,3-dihydrothiophene
CID 68199908

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide?
The IUPAC name of 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide (CID 142910459) is 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide.
What is the SMILES notation for 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide?
The canonical SMILES for 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide is C=CC1=C(C=C)S(=O)CC1.
What is the InChIKey of 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide?
The InChIKey is GSYYKNGAPMDDLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10OS/c1-3-7-5-6-10(9)8(7)4-2/h3-4H,1-2,5-6H2.
What are the key properties of 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide?
4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide has a molecular weight of 154.23 g/mol, XLogP of 1.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-2,3-dihydrothiophene 1-oxide is sourced from PubChem (CID 142910459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).