(6-fluoro-1-benzofuran-7-yl)methanol

C9H7FO2 — CID 117276362

IUPAC(6-fluoro-1-benzofuran-7-yl)methanol
SMILESOCc1c(F)ccc2ccoc12
InChIInChI=1S/C9H7FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-4,11H,5H2
InChIKeyVXWWUFOGARAKRY-UHFFFAOYSA-N
MW166.15 g/mol
LogP2.06
Rot. Bonds1

About (6-fluoro-1-benzofuran-7-yl)methanol

(6-fluoro-1-benzofuran-7-yl)methanol (PubChem CID 117276362) has the molecular formula C9H7FO2 and a molecular weight of 166.15 g/mol. Its IUPAC name is (6-fluoro-1-benzofuran-7-yl)methanol.

Molecular Properties

Compound Name(6-fluoro-1-benzofuran-7-yl)methanol
PubChem CID117276362
Molecular FormulaC9H7FO2
Molecular Weight166.15 g/mol
Exact Mass166.04
IUPAC Name(6-fluoro-1-benzofuran-7-yl)methanol
SMILESOCc1c(F)ccc2ccoc12
InChIInChI=1S/C9H7FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-4,11H,5H2
InChIKeyVXWWUFOGARAKRY-UHFFFAOYSA-N
XLogP2.06
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(6-fluoro-1-benzofuran-7-yl)methyl]hydroxylamine
CID 117278576
6-fluoro-1-benzofuran-7-ol
CID 164580528
6-fluoro-7-(isocyanatomethyl)-1-benzofuran
CID 117282115
(5,7-difluoro-1-benzofuran-4-yl)methanol
CID 117279692
7-bromo-6-fluoro-1-benzofuran
CID 22144929
9-(hydroxymethyl)furo[3,2-g]chromen-7-one
CID 20823678
3-amino-2-(6-fluoro-1-benzofuran-7-yl)propanoic acid
CID 117319085
2-(6-fluoro-1-benzofuran-7-yl)propan-1-amine
CID 117283511
1-(6-fluoro-1-benzofuran-7-yl)cyclobutane-1-carboxylic acid
CID 117339985
methyl 2-(6-fluoro-1-benzofuran-7-yl)-2-hydroxyacetate
CID 117321227
7-bromo-1-benzofuran-6-ol
CID 83681550
3-(6-fluoro-1-benzofuran-7-yl)-1,2-oxazol-5-amine
CID 117310537

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-1-benzofuran-7-yl)methanol?
The IUPAC name of (6-fluoro-1-benzofuran-7-yl)methanol (CID 117276362) is (6-fluoro-1-benzofuran-7-yl)methanol.
What is the SMILES notation for (6-fluoro-1-benzofuran-7-yl)methanol?
The canonical SMILES for (6-fluoro-1-benzofuran-7-yl)methanol is OCc1c(F)ccc2ccoc12.
What is the InChIKey of (6-fluoro-1-benzofuran-7-yl)methanol?
The InChIKey is VXWWUFOGARAKRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-4,11H,5H2.
What are the key properties of (6-fluoro-1-benzofuran-7-yl)methanol?
(6-fluoro-1-benzofuran-7-yl)methanol has a molecular weight of 166.15 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-1-benzofuran-7-yl)methanol is sourced from PubChem (CID 117276362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).