(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol

C13H9FO3 — CID 114723330

IUPAC(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol
SMILESOC(c1ccco1)c1cc2cccc(F)c2o1
InChIInChI=1S/C13H9FO3/c14-9-4-1-3-8-7-11(17-13(8)9)12(15)10-5-2-6-16-10/h1-7,12,15H
InChIKeySGQODPAEDWEUIO-UHFFFAOYSA-N
MW232.21 g/mol
LogP3.25
Rot. Bonds2

About (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol

(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol (PubChem CID 114723330) has the molecular formula C13H9FO3 and a molecular weight of 232.21 g/mol. Its IUPAC name is (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol.

Molecular Properties

Compound Name(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol
PubChem CID114723330
Molecular FormulaC13H9FO3
Molecular Weight232.21 g/mol
Exact Mass232.05
IUPAC Name(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol
SMILESOC(c1ccco1)c1cc2cccc(F)c2o1
InChIInChI=1S/C13H9FO3/c14-9-4-1-3-8-7-11(17-13(8)9)12(15)10-5-2-6-16-10/h1-7,12,15H
InChIKeySGQODPAEDWEUIO-UHFFFAOYSA-N
XLogP3.25
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.21
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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)-(2,4,6-trifluorophenyl)methanol
CID 115836932
(7-fluoro-1-benzofuran-2-yl)-(4-iodophenyl)methanol
CID 115836962
(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
(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726486
(5-chloro-2-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115837002
1,3-dihydro-2-benzofuran-5-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115836912
(2-amino-4-chlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726577
3-[(7-fluoro-1-benzofuran-2-yl)-hydroxymethyl]benzonitrile
CID 114724502

Frequently Asked Questions

What is the IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol?
The IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol (CID 114723330) is (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol.
What is the SMILES notation for (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol?
The canonical SMILES for (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol is OC(c1ccco1)c1cc2cccc(F)c2o1.
What is the InChIKey of (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol?
The InChIKey is SGQODPAEDWEUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FO3/c14-9-4-1-3-8-7-11(17-13(8)9)12(15)10-5-2-6-16-10/h1-7,12,15H.
What are the key properties of (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol?
(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol has a molecular weight of 232.21 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol is sourced from PubChem (CID 114723330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).