2-[2-fluoro-4-(trifluoromethyl)phenyl]furan

C11H6F4O — CID 168524503

IUPAC2-[2-fluoro-4-(trifluoromethyl)phenyl]furan
SMILESFc1cc(C(F)(F)F)ccc1-c1ccco1
InChIInChI=1S/C11H6F4O/c12-9-6-7(11(13,14)15)3-4-8(9)10-2-1-5-16-10/h1-6H
InChIKeyITEKKLQLBMRPNR-UHFFFAOYSA-N
MW230.16 g/mol
LogP4.10
Rot. Bonds1

About 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan

2-[2-fluoro-4-(trifluoromethyl)phenyl]furan (PubChem CID 168524503) has the molecular formula C11H6F4O and a molecular weight of 230.16 g/mol. Its IUPAC name is 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan.

Molecular Properties

Compound Name2-[2-fluoro-4-(trifluoromethyl)phenyl]furan
PubChem CID168524503
Molecular FormulaC11H6F4O
Molecular Weight230.16 g/mol
Exact Mass230.04
IUPAC Name2-[2-fluoro-4-(trifluoromethyl)phenyl]furan
SMILESFc1cc(C(F)(F)F)ccc1-c1ccco1
InChIInChI=1S/C11H6F4O/c12-9-6-7(11(13,14)15)3-4-8(9)10-2-1-5-16-10/h1-6H
InChIKeyITEKKLQLBMRPNR-UHFFFAOYSA-N
XLogP4.10
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.16
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-bromo-3-fluoro-5-(trifluoromethyl)phenyl]furan
CID 168526241
1-[2-(furan-2-yl)-4-(trifluoromethyl)phenyl]pyrrolidine
CID 168524729
2-[2-nitro-5-(trifluoromethyl)phenyl]furan
CID 168526595
2-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)phenyl]furan
CID 168528176
2-(2-fluorophenyl)furan
CID 10511186
2-[4-[2,6-difluoro-4-(trifluoromethyl)phenoxy]-3,5-difluorophenyl]furan
CID 168528467
1-[2-(furan-2-yl)-4-(trifluoromethyl)phenyl]-4-methylpiperazine
CID 168525964
3-[2-fluoro-4-(trifluoromethyl)phenyl]-1,2-oxazole
CID 91177416
2-[2-(2-methoxyphenoxy)-5-(trifluoromethyl)phenyl]furan
CID 168524965
2-[2-(4-phenylphenoxy)-5-(trifluoromethyl)phenyl]furan
CID 168525850
2-[2,6-dichloro-4-(trifluoromethyl)phenyl]furan
CID 90729865
2-[3-[2,6-difluoro-4-(trifluoromethyl)phenoxy]-4-fluorophenyl]furan
CID 168528480

Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan?
The IUPAC name of 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan (CID 168524503) is 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan.
What is the SMILES notation for 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan?
The canonical SMILES for 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan is Fc1cc(C(F)(F)F)ccc1-c1ccco1.
What is the InChIKey of 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan?
The InChIKey is ITEKKLQLBMRPNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F4O/c12-9-6-7(11(13,14)15)3-4-8(9)10-2-1-5-16-10/h1-6H.
What are the key properties of 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan?
2-[2-fluoro-4-(trifluoromethyl)phenyl]furan has a molecular weight of 230.16 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoro-4-(trifluoromethyl)phenyl]furan is sourced from PubChem (CID 168524503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).