2,3,4,5-tetramethyl-2,3-dihydrothiophene

C8H14S — CID 76814809

IUPAC2,3,4,5-tetramethyl-2,3-dihydrothiophene
SMILESCC1=C(C)C(C)C(C)S1
InChIInChI=1S/C8H14S/c1-5-6(2)8(4)9-7(5)3/h5,7H,1-4H3
InChIKeyHWTJCHZWSDWGLP-UHFFFAOYSA-N
MW142.27 g/mol
LogP3.05
Rot. Bonds

About 2,3,4,5-tetramethyl-2,3-dihydrothiophene

2,3,4,5-tetramethyl-2,3-dihydrothiophene (PubChem CID 76814809) has the molecular formula C8H14S and a molecular weight of 142.27 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-2,3-dihydrothiophene.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-2,3-dihydrothiophene
PubChem CID76814809
Molecular FormulaC8H14S
Molecular Weight142.27 g/mol
Exact Mass142.08
IUPAC Name2,3,4,5-tetramethyl-2,3-dihydrothiophene
SMILESCC1=C(C)C(C)C(C)S1
InChIInChI=1S/C8H14S/c1-5-6(2)8(4)9-7(5)3/h5,7H,1-4H3
InChIKeyHWTJCHZWSDWGLP-UHFFFAOYSA-N
XLogP3.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.27
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-2,3-dihydrothiophene?
The IUPAC name of 2,3,4,5-tetramethyl-2,3-dihydrothiophene (CID 76814809) is 2,3,4,5-tetramethyl-2,3-dihydrothiophene.
What is the SMILES notation for 2,3,4,5-tetramethyl-2,3-dihydrothiophene?
The canonical SMILES for 2,3,4,5-tetramethyl-2,3-dihydrothiophene is CC1=C(C)C(C)C(C)S1.
What is the InChIKey of 2,3,4,5-tetramethyl-2,3-dihydrothiophene?
The InChIKey is HWTJCHZWSDWGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14S/c1-5-6(2)8(4)9-7(5)3/h5,7H,1-4H3.
What are the key properties of 2,3,4,5-tetramethyl-2,3-dihydrothiophene?
2,3,4,5-tetramethyl-2,3-dihydrothiophene has a molecular weight of 142.27 g/mol, XLogP of 3.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-2,3-dihydrothiophene is sourced from PubChem (CID 76814809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).