[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol

C16H14F2O3 — CID 114743255

IUPAC[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol
SMILESOC(c1ccccc1OC(F)F)c1cccc2c1OCC2
InChIInChI=1S/C16H14F2O3/c17-16(18)21-13-7-2-1-5-11(13)14(19)12-6-3-4-10-8-9-20-15(10)12/h1-7,14,16,19H,8-9H2
InChIKeyJEKFOSRYEFHZKH-UHFFFAOYSA-N
MW292.28 g/mol
LogP3.30
Rot. Bonds4

About [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol

[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol (PubChem CID 114743255) has the molecular formula C16H14F2O3 and a molecular weight of 292.28 g/mol. Its IUPAC name is [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol.

Molecular Properties

Compound Name[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol
PubChem CID114743255
Molecular FormulaC16H14F2O3
Molecular Weight292.28 g/mol
Exact Mass292.09
IUPAC Name[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol
SMILESOC(c1ccccc1OC(F)F)c1cccc2c1OCC2
InChIInChI=1S/C16H14F2O3/c17-16(18)21-13-7-2-1-5-11(13)14(19)12-6-3-4-10-8-9-20-15(10)12/h1-7,14,16,19H,8-9H2
InChIKeyJEKFOSRYEFHZKH-UHFFFAOYSA-N
XLogP3.30
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydro-1-benzofuran-7-yl-(2-iodophenyl)methanol
CID 115838946
(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743289
2,3-dihydro-1-benzofuran-7-yl(naphthalen-1-yl)methanol
CID 114743291
2,3-dihydro-1-benzofuran-7-yl-(4-propan-2-yloxyphenyl)methanol
CID 114743236
3,4-dihydro-2H-chromen-8-yl-(2-fluorophenyl)methanol
CID 114743309
3,4-dihydro-2H-chromen-8-yl-(2-iodophenyl)methanol
CID 115837843
1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 68614116
2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
CID 114744728
(2-bromo-3,4-difluorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 107538425
2,3-dihydro-1-benzofuran-7-yl-(2-fluoro-4-methoxyphenyl)methanol
CID 114744709
2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethylphenyl)methanol
CID 114743334
3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol
CID 114743328

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol?
The IUPAC name of [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol (CID 114743255) is [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol.
What is the SMILES notation for [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol?
The canonical SMILES for [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol is OC(c1ccccc1OC(F)F)c1cccc2c1OCC2.
What is the InChIKey of [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol?
The InChIKey is JEKFOSRYEFHZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2O3/c17-16(18)21-13-7-2-1-5-11(13)14(19)12-6-3-4-10-8-9-20-15(10)12/h1-7,14,16,19H,8-9H2.
What are the key properties of [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol?
[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol has a molecular weight of 292.28 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol is sourced from PubChem (CID 114743255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).