(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol

C15H9ClF2O2 — CID 114726486

IUPAC(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
SMILESOC(c1cc2cccc(F)c2o1)c1ccc(F)cc1Cl
InChIInChI=1S/C15H9ClF2O2/c16-11-7-9(17)4-5-10(11)14(19)13-6-8-2-1-3-12(18)15(8)20-13/h1-7,14,19H
InChIKeyDJGBNPLWNYSCIK-UHFFFAOYSA-N
MW294.68 g/mol
LogP4.45
Rot. Bonds2

About (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol

(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol (PubChem CID 114726486) has the molecular formula C15H9ClF2O2 and a molecular weight of 294.68 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
PubChem CID114726486
Molecular FormulaC15H9ClF2O2
Molecular Weight294.68 g/mol
Exact Mass294.03
IUPAC Name(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
SMILESOC(c1cc2cccc(F)c2o1)c1ccc(F)cc1Cl
InChIInChI=1S/C15H9ClF2O2/c16-11-7-9(17)4-5-10(11)14(19)13-6-8-2-1-3-12(18)15(8)20-13/h1-7,14,19H
InChIKeyDJGBNPLWNYSCIK-UHFFFAOYSA-N
XLogP4.45
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.68
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanamine
CID 115957488
(2-amino-4-chlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726577
(5-chloro-2-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115837002
(7-chloro-1-benzofuran-2-yl)-(2-chloro-3-fluorophenyl)methanol
CID 115837553
(2,4-dibromophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 107947837
(2-bromo-5-fluorophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 115837557
(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol
CID 115836932
(7-chloro-1-benzofuran-2-yl)-(2-fluoro-4-methylphenyl)methanol
CID 115837454
1-benzofuran-2-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114723565
(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol
CID 114723330
(2-chloro-4-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanamine
CID 106858732
(7-bromo-1-benzofuran-2-yl)-(4-fluoro-2-methylphenyl)methanol
CID 105093821

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol?
The IUPAC name of (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol (CID 114726486) is (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol.
What is the SMILES notation for (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol?
The canonical SMILES for (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol is OC(c1cc2cccc(F)c2o1)c1ccc(F)cc1Cl.
What is the InChIKey of (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol?
The InChIKey is DJGBNPLWNYSCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClF2O2/c16-11-7-9(17)4-5-10(11)14(19)13-6-8-2-1-3-12(18)15(8)20-13/h1-7,14,19H.
What are the key properties of (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol?
(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol has a molecular weight of 294.68 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 114726486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).