3-fluoro-4-methyl-2-methylsulfanylthiophene

C6H7FS2 — CID 154964882

IUPAC3-fluoro-4-methyl-2-methylsulfanylthiophene
SMILESCSc1scc(C)c1F
InChIInChI=1S/C6H7FS2/c1-4-3-9-6(8-2)5(4)7/h3H,1-2H3
InChIKeyBXDRWMBOZNNLMA-UHFFFAOYSA-N
MW162.25 g/mol
LogP2.92
Rot. Bonds1

About 3-fluoro-4-methyl-2-methylsulfanylthiophene

3-fluoro-4-methyl-2-methylsulfanylthiophene (PubChem CID 154964882) has the molecular formula C6H7FS2 and a molecular weight of 162.25 g/mol. Its IUPAC name is 3-fluoro-4-methyl-2-methylsulfanylthiophene.

Molecular Properties

Compound Name3-fluoro-4-methyl-2-methylsulfanylthiophene
PubChem CID154964882
Molecular FormulaC6H7FS2
Molecular Weight162.25 g/mol
Exact Mass162.00
IUPAC Name3-fluoro-4-methyl-2-methylsulfanylthiophene
SMILESCSc1scc(C)c1F
InChIInChI=1S/C6H7FS2/c1-4-3-9-6(8-2)5(4)7/h3H,1-2H3
InChIKeyBXDRWMBOZNNLMA-UHFFFAOYSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.25
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-methyl-2-methylsulfanylthiophene?
The IUPAC name of 3-fluoro-4-methyl-2-methylsulfanylthiophene (CID 154964882) is 3-fluoro-4-methyl-2-methylsulfanylthiophene.
What is the SMILES notation for 3-fluoro-4-methyl-2-methylsulfanylthiophene?
The canonical SMILES for 3-fluoro-4-methyl-2-methylsulfanylthiophene is CSc1scc(C)c1F.
What is the InChIKey of 3-fluoro-4-methyl-2-methylsulfanylthiophene?
The InChIKey is BXDRWMBOZNNLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FS2/c1-4-3-9-6(8-2)5(4)7/h3H,1-2H3.
What are the key properties of 3-fluoro-4-methyl-2-methylsulfanylthiophene?
3-fluoro-4-methyl-2-methylsulfanylthiophene has a molecular weight of 162.25 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-methyl-2-methylsulfanylthiophene is sourced from PubChem (CID 154964882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).