2-fluoro-3,4-dimethylthiophene

C6H7FS — CID 138494996

IUPAC2-fluoro-3,4-dimethylthiophene
SMILESCc1csc(F)c1C
InChIInChI=1S/C6H7FS/c1-4-3-8-6(7)5(4)2/h3H,1-2H3
InChIKeyGOBNXPZOXBQTOT-UHFFFAOYSA-N
MW130.19 g/mol
LogP2.50
Rot. Bonds

About 2-fluoro-3,4-dimethylthiophene

2-fluoro-3,4-dimethylthiophene (PubChem CID 138494996) has the molecular formula C6H7FS and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-fluoro-3,4-dimethylthiophene.

Molecular Properties

Compound Name2-fluoro-3,4-dimethylthiophene
PubChem CID138494996
Molecular FormulaC6H7FS
Molecular Weight130.19 g/mol
Exact Mass130.03
IUPAC Name2-fluoro-3,4-dimethylthiophene
SMILESCc1csc(F)c1C
InChIInChI=1S/C6H7FS/c1-4-3-8-6(7)5(4)2/h3H,1-2H3
InChIKeyGOBNXPZOXBQTOT-UHFFFAOYSA-N
XLogP2.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

CID 79089
CID 79089
CID 22212065
CID 22212065
CID 22572180
CID 22572180
CID 13040458
CID 13040458
CID 54552142
CID 54552142
CID 528871
CID 528871
CID 21732092
CID 21732092
CID 68504621
CID 68504621
CID 15640922
CID 15640922
CID 54250212
CID 54250212
CID 57315363
CID 57315363
CID 117736427
CID 117736427

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3,4-dimethylthiophene?
The IUPAC name of 2-fluoro-3,4-dimethylthiophene (CID 138494996) is 2-fluoro-3,4-dimethylthiophene.
What is the SMILES notation for 2-fluoro-3,4-dimethylthiophene?
The canonical SMILES for 2-fluoro-3,4-dimethylthiophene is Cc1csc(F)c1C.
What is the InChIKey of 2-fluoro-3,4-dimethylthiophene?
The InChIKey is GOBNXPZOXBQTOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FS/c1-4-3-8-6(7)5(4)2/h3H,1-2H3.
What are the key properties of 2-fluoro-3,4-dimethylthiophene?
2-fluoro-3,4-dimethylthiophene has a molecular weight of 130.19 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3,4-dimethylthiophene is sourced from PubChem (CID 138494996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).