2-methylidenethiolane 1,1-dioxide

C5H8O2S — CID 10351733

IUPAC2-methylidenethiolane 1,1-dioxide
SMILESC=C1CCCS1(=O)=O
InChIInChI=1S/C5H8O2S/c1-5-3-2-4-8(5,6)7/h1-4H2
InChIKeyDORBHRIAVFQFBG-UHFFFAOYSA-N
MW132.18 g/mol
LogP0.71
Rot. Bonds

About 2-methylidenethiolane 1,1-dioxide

2-methylidenethiolane 1,1-dioxide (PubChem CID 10351733) has the molecular formula C5H8O2S and a molecular weight of 132.18 g/mol. Its IUPAC name is 2-methylidenethiolane 1,1-dioxide.

Molecular Properties

Compound Name2-methylidenethiolane 1,1-dioxide
PubChem CID10351733
Molecular FormulaC5H8O2S
Molecular Weight132.18 g/mol
Exact Mass132.02
IUPAC Name2-methylidenethiolane 1,1-dioxide
SMILESC=C1CCCS1(=O)=O
InChIInChI=1S/C5H8O2S/c1-5-3-2-4-8(5,6)7/h1-4H2
InChIKeyDORBHRIAVFQFBG-UHFFFAOYSA-N
XLogP0.71
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethenyl-1lambda6-thiolane-1,1-dione
CID 90355228
2,5-Diethenyl-1lambda~6~-thiolane-1,1-dione
CID 12634220
Thiophene, 4-(butylthio)-2,3-dihydro-, 1,1-dioxide
CID 3884409
3,4-Dimethylene-thiolane 1,1-dioxide
CID 12607497
cis-2,5-Divinylsulfolane
CID 23272235
trans-2,5-Divinylsulfolane
CID 129790691
2-Methylidenethiane 1,1-dioxide
CID 10057630
2-Methylidenethiolane 1-oxide
CID 11137140
2,5-Dimethylidenethiolane 1,1-dioxide
CID 13053216
4-Methylsulfanyl-2,3-dihydrothiophene 1,1-dioxide
CID 13071993
3-Methylidenethiolane 1,1-dioxide
CID 13929140
5-Ethenylsulfonylpent-1-ene
CID 20616006

Frequently Asked Questions

What is the IUPAC name of 2-methylidenethiolane 1,1-dioxide?
The IUPAC name of 2-methylidenethiolane 1,1-dioxide (CID 10351733) is 2-methylidenethiolane 1,1-dioxide.
What is the SMILES notation for 2-methylidenethiolane 1,1-dioxide?
The canonical SMILES for 2-methylidenethiolane 1,1-dioxide is C=C1CCCS1(=O)=O.
What is the InChIKey of 2-methylidenethiolane 1,1-dioxide?
The InChIKey is DORBHRIAVFQFBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O2S/c1-5-3-2-4-8(5,6)7/h1-4H2.
What are the key properties of 2-methylidenethiolane 1,1-dioxide?
2-methylidenethiolane 1,1-dioxide has a molecular weight of 132.18 g/mol, XLogP of 0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidenethiolane 1,1-dioxide is sourced from PubChem (CID 10351733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).