2-fluoro-4-(trifluoromethyl)thiophene

C5H2F4S — CID 129317810

IUPAC2-fluoro-4-(trifluoromethyl)thiophene
SMILESFc1cc(C(F)(F)F)cs1
InChIInChI=1S/C5H2F4S/c6-4-1-3(2-10-4)5(7,8)9/h1-2H
InChIKeyKCKZVEWKAJNFDB-UHFFFAOYSA-N
MW170.13 g/mol
LogP2.91
Rot. Bonds

About 2-fluoro-4-(trifluoromethyl)thiophene

2-fluoro-4-(trifluoromethyl)thiophene (PubChem CID 129317810) has the molecular formula C5H2F4S and a molecular weight of 170.13 g/mol. Its IUPAC name is 2-fluoro-4-(trifluoromethyl)thiophene.

Molecular Properties

Compound Name2-fluoro-4-(trifluoromethyl)thiophene
PubChem CID129317810
Molecular FormulaC5H2F4S
Molecular Weight170.13 g/mol
Exact Mass169.98
IUPAC Name2-fluoro-4-(trifluoromethyl)thiophene
SMILESFc1cc(C(F)(F)F)cs1
InChIInChI=1S/C5H2F4S/c6-4-1-3(2-10-4)5(7,8)9/h1-2H
InChIKeyKCKZVEWKAJNFDB-UHFFFAOYSA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.13
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-4-(trifluoromethyl)thiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-bis(trifluoromethyl)thiophene
CID 13040463
4-(trifluoromethyl)thiophen-2-amine;hydrochloride
CID 22293888
2-[4-(trifluoromethyl)thiophen-2-yl]-1H-imidazole
CID 67694656
5-[4-(trifluoromethyl)thiophen-2-yl]-1H-pyrazole
CID 150661370
7-propan-2-yl-3-(trifluoromethyl)cyclopenta[b]thiopyran
CID 174867682
2-fluoro-1,3,5-tris(trifluoromethyl)benzene
CID 12503713
2-[4-(trifluoromethyl)thiophen-2-yl]butanoate
CID 151925243
propyl 4-(trifluoromethyl)thiophene-2-carboxylate
CID 18434668
4-[2,6-difluoro-4-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 58026097
2-[2-oxo-2-[[4-(trifluoromethyl)thiophen-2-yl]amino]ethyl]sulfanylacetamide
CID 166306564
2-bromo-1,3-difluoro-5-(trifluoromethyl)benzene
CID 2778983
3-(trifluoromethyl)thiophene
CID 2769441

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(trifluoromethyl)thiophene?
The IUPAC name of 2-fluoro-4-(trifluoromethyl)thiophene (CID 129317810) is 2-fluoro-4-(trifluoromethyl)thiophene.
What is the SMILES notation for 2-fluoro-4-(trifluoromethyl)thiophene?
The canonical SMILES for 2-fluoro-4-(trifluoromethyl)thiophene is Fc1cc(C(F)(F)F)cs1.
What is the InChIKey of 2-fluoro-4-(trifluoromethyl)thiophene?
The InChIKey is KCKZVEWKAJNFDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F4S/c6-4-1-3(2-10-4)5(7,8)9/h1-2H.
What are the key properties of 2-fluoro-4-(trifluoromethyl)thiophene?
2-fluoro-4-(trifluoromethyl)thiophene has a molecular weight of 170.13 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(trifluoromethyl)thiophene is sourced from PubChem (CID 129317810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).