2-[2-chloro-5-(trifluoromethyl)phenyl]furan

C11H6ClF3O — CID 610202

IUPAC2-[2-chloro-5-(trifluoromethyl)phenyl]furan
SMILESFC(F)(F)c1ccc(Cl)c(-c2ccco2)c1
InChIInChI=1S/C11H6ClF3O/c12-9-4-3-7(11(13,14)15)6-8(9)10-2-1-5-16-10/h1-6H
InChIKeyOHGJMFOEJMXJFM-UHFFFAOYSA-N
MW246.62 g/mol
LogP4.62
Rot. Bonds1

About 2-[2-chloro-5-(trifluoromethyl)phenyl]furan

2-[2-chloro-5-(trifluoromethyl)phenyl]furan (PubChem CID 610202) has the molecular formula C11H6ClF3O and a molecular weight of 246.62 g/mol. Its IUPAC name is 2-[2-chloro-5-(trifluoromethyl)phenyl]furan.

Molecular Properties

Compound Name2-[2-chloro-5-(trifluoromethyl)phenyl]furan
PubChem CID610202
Molecular FormulaC11H6ClF3O
Molecular Weight246.62 g/mol
Exact Mass246.01
IUPAC Name2-[2-chloro-5-(trifluoromethyl)phenyl]furan
SMILESFC(F)(F)c1ccc(Cl)c(-c2ccco2)c1
InChIInChI=1S/C11H6ClF3O/c12-9-4-3-7(11(13,14)15)6-8(9)10-2-1-5-16-10/h1-6H
InChIKeyOHGJMFOEJMXJFM-UHFFFAOYSA-N
XLogP4.62
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.62
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-5-(trifluoromethyl)phenyl]furan?
The IUPAC name of 2-[2-chloro-5-(trifluoromethyl)phenyl]furan (CID 610202) is 2-[2-chloro-5-(trifluoromethyl)phenyl]furan.
What is the SMILES notation for 2-[2-chloro-5-(trifluoromethyl)phenyl]furan?
The canonical SMILES for 2-[2-chloro-5-(trifluoromethyl)phenyl]furan is FC(F)(F)c1ccc(Cl)c(-c2ccco2)c1.
What is the InChIKey of 2-[2-chloro-5-(trifluoromethyl)phenyl]furan?
The InChIKey is OHGJMFOEJMXJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF3O/c12-9-4-3-7(11(13,14)15)6-8(9)10-2-1-5-16-10/h1-6H.
What are the key properties of 2-[2-chloro-5-(trifluoromethyl)phenyl]furan?
2-[2-chloro-5-(trifluoromethyl)phenyl]furan has a molecular weight of 246.62 g/mol, XLogP of 4.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-5-(trifluoromethyl)phenyl]furan is sourced from PubChem (CID 610202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).