(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol

C15H8F4O2 — CID 115836932

IUPAC(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol
SMILESOC(c1cc2cccc(F)c2o1)c1c(F)cc(F)cc1F
InChIInChI=1S/C15H8F4O2/c16-8-5-10(18)13(11(19)6-8)14(20)12-4-7-2-1-3-9(17)15(7)21-12/h1-6,14,20H
InChIKeyQOLUGYOAYOGBHU-UHFFFAOYSA-N
MW296.22 g/mol
LogP4.07
Rot. Bonds2

About (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol

(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol (PubChem CID 115836932) has the molecular formula C15H8F4O2 and a molecular weight of 296.22 g/mol. Its IUPAC name is (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol.

Molecular Properties

Compound Name(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol
PubChem CID115836932
Molecular FormulaC15H8F4O2
Molecular Weight296.22 g/mol
Exact Mass296.05
IUPAC Name(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol
SMILESOC(c1cc2cccc(F)c2o1)c1c(F)cc(F)cc1F
InChIInChI=1S/C15H8F4O2/c16-8-5-10(18)13(11(19)6-8)14(20)12-4-7-2-1-3-9(17)15(7)21-12/h1-6,14,20H
InChIKeyQOLUGYOAYOGBHU-UHFFFAOYSA-N
XLogP4.07
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.22
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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
(7-fluoro-1-benzofuran-2-yl)-(4-iodophenyl)methanol
CID 115836962
(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726486
(2,4-dibromophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 107947837
(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-methylphenyl)methanol
CID 114723604
7-fluoro-2-propan-2-yl-1-benzofuran
CID 88991552
4-[(7-fluoro-1-benzofuran-2-yl)-hydroxymethyl]benzonitrile
CID 114724496
(7-methyl-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 105045627
(5-chloro-2-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115837002
(2-amino-4-chlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726577
1,3-dihydro-2-benzofuran-5-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115836912

Frequently Asked Questions

What is the IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol?
The IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol (CID 115836932) is (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol.
What is the SMILES notation for (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol?
The canonical SMILES for (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol is OC(c1cc2cccc(F)c2o1)c1c(F)cc(F)cc1F.
What is the InChIKey of (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol?
The InChIKey is QOLUGYOAYOGBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F4O2/c16-8-5-10(18)13(11(19)6-8)14(20)12-4-7-2-1-3-9(17)15(7)21-12/h1-6,14,20H.
What are the key properties of (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol?
(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol has a molecular weight of 296.22 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol is sourced from PubChem (CID 115836932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).