2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol

C18H18O3 — CID 114744588

IUPAC2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol
SMILESOC(c1cccc2c1OCC2)C1COc2ccccc2C1
InChIInChI=1S/C18H18O3/c19-17(15-6-3-5-12-8-9-20-18(12)15)14-10-13-4-1-2-7-16(13)21-11-14/h1-7,14,17,19H,8-11H2
InChIKeyGPLRIXCKBSFJQZ-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.91
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol

2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol (PubChem CID 114744588) has the molecular formula C18H18O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol
PubChem CID114744588
Molecular FormulaC18H18O3
Molecular Weight282.34 g/mol
Exact Mass282.13
IUPAC Name2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol
SMILESOC(c1cccc2c1OCC2)C1COc2ccccc2C1
InChIInChI=1S/C18H18O3/c19-17(15-6-3-5-12-8-9-20-18(12)15)14-10-13-4-1-2-7-16(13)21-11-14/h1-7,14,17,19H,8-11H2
InChIKeyGPLRIXCKBSFJQZ-UHFFFAOYSA-N
XLogP2.91
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-chromen-3-yl-(2,3,4-trifluorophenyl)methanol
CID 65411549
3,4-dihydro-2H-chromen-3-yl-(3,4-dimethylphenyl)methanol
CID 65412330
2,3-dihydro-1-benzofuran-7-yl(2,3-dihydro-1-benzothiophen-3-yl)methanol
CID 105132247
1-(3,4-dihydro-2H-chromen-3-yl)-2-methylbutan-1-ol
CID 79446324
1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 68614116
2,3-dihydro-1-benzofuran-7-yl-(2-iodophenyl)methanol
CID 115838946
5-[3,4-dihydro-2H-chromen-3-yl(hydroxy)methyl]furan-2-carboxylic acid
CID 106947406
3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol
CID 65412130
2-amino-1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 102547105
(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743289
2,3-dihydro-1-benzofuran-7-yl-(1-methylcyclopropyl)methanol
CID 114744695
2,3-dihydro-1-benzofuran-7-yl(naphthalen-1-yl)methanol
CID 114743291

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol (CID 114744588) is 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol is OC(c1cccc2c1OCC2)C1COc2ccccc2C1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol?
The InChIKey is GPLRIXCKBSFJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O3/c19-17(15-6-3-5-12-8-9-20-18(12)15)14-10-13-4-1-2-7-16(13)21-11-14/h1-7,14,17,19H,8-11H2.
What are the key properties of 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol?
2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol has a molecular weight of 282.34 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol is sourced from PubChem (CID 114744588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).