(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol

C9H9FO2 — CID 117276567

IUPAC(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol
SMILESOCc1c(F)ccc2c1OCC2
InChIInChI=1S/C9H9FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-2,11H,3-5H2
InChIKeyIRYJDZOTUIXSSP-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.25
Rot. Bonds1

About (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol

(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol (PubChem CID 117276567) has the molecular formula C9H9FO2 and a molecular weight of 168.17 g/mol. Its IUPAC name is (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol.

Molecular Properties

Compound Name(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol
PubChem CID117276567
Molecular FormulaC9H9FO2
Molecular Weight168.17 g/mol
Exact Mass168.06
IUPAC Name(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol
SMILESOCc1c(F)ccc2c1OCC2
InChIInChI=1S/C9H9FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-2,11H,3-5H2
InChIKeyIRYJDZOTUIXSSP-UHFFFAOYSA-N
XLogP1.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)acetonitrile
CID 117277411
1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)-2-methylpropan-2-amine
CID 117298789
7-fluoro-3,4-dihydro-2H-chromen-8-ol
CID 10630931
(E)-3-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)prop-2-en-1-amine
CID 117283537
3-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)propanal
CID 117297394
4-amino-4-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)butanoic acid
CID 117350314
7-fluoro-3,4-dihydro-2H-chromene-8-carboxylic acid
CID 22404817
(7-fluoro-2,3-dihydro-1-benzofuran-6-yl)boronic acid
CID 154669878
6-(bromomethyl)-7-fluoro-2,3-dihydro-1-benzofuran
CID 171829628
1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine
CID 117295877
7-butyl-2,3-dihydro-1-benzofuran-6-ol;ethane
CID 177208439
8-bromo-7-fluoro-3,4-dihydro-2H-chromene
CID 155778553

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol?
The IUPAC name of (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol (CID 117276567) is (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol.
What is the SMILES notation for (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol?
The canonical SMILES for (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol is OCc1c(F)ccc2c1OCC2.
What is the InChIKey of (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol?
The InChIKey is IRYJDZOTUIXSSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO2/c10-8-2-1-6-3-4-12-9(6)7(8)5-11/h1-2,11H,3-5H2.
What are the key properties of (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol?
(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol has a molecular weight of 168.17 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol is sourced from PubChem (CID 117276567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).