1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide

C8H10O2S2 — CID 11084903

IUPAC1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide
SMILESCc1sc(C)c2c1CS(=O)(=O)C2
InChIInChI=1S/C8H10O2S2/c1-5-7-3-12(9,10)4-8(7)6(2)11-5/h3-4H2,1-2H3
InChIKeyTYDRLVWOHPVOGA-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.79
Rot. Bonds

About 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide

1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide (PubChem CID 11084903) has the molecular formula C8H10O2S2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide.

Molecular Properties

Compound Name1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide
PubChem CID11084903
Molecular FormulaC8H10O2S2
Molecular Weight202.30 g/mol
Exact Mass202.01
IUPAC Name1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide
SMILESCc1sc(C)c2c1CS(=O)(=O)C2
InChIInChI=1S/C8H10O2S2/c1-5-7-3-12(9,10)4-8(7)6(2)11-5/h3-4H2,1-2H3
InChIKeyTYDRLVWOHPVOGA-UHFFFAOYSA-N
XLogP1.79
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide?
The IUPAC name of 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide (CID 11084903) is 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide.
What is the SMILES notation for 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide?
The canonical SMILES for 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide is Cc1sc(C)c2c1CS(=O)(=O)C2.
What is the InChIKey of 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide?
The InChIKey is TYDRLVWOHPVOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2S2/c1-5-7-3-12(9,10)4-8(7)6(2)11-5/h3-4H2,1-2H3.
What are the key properties of 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide?
1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide has a molecular weight of 202.30 g/mol, XLogP of 1.79, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4,6-dihydrothieno[3,4-c]thiophene 5,5-dioxide is sourced from PubChem (CID 11084903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).