1-(1,3-dihydro-2-benzofuran-5-yl)ethanol

C10H12O2 — CID 63020955

IUPAC1-(1,3-dihydro-2-benzofuran-5-yl)ethanol
SMILESCC(O)c1ccc2c(c1)COC2
InChIInChI=1S/C10H12O2/c1-7(11)8-2-3-9-5-12-6-10(9)4-8/h2-4,7,11H,5-6H2,1H3
InChIKeyCJWDCKMVJZTUHG-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.77
Rot. Bonds1

About 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol

1-(1,3-dihydro-2-benzofuran-5-yl)ethanol (PubChem CID 63020955) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol.

Molecular Properties

Compound Name1-(1,3-dihydro-2-benzofuran-5-yl)ethanol
PubChem CID63020955
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name1-(1,3-dihydro-2-benzofuran-5-yl)ethanol
SMILESCC(O)c1ccc2c(c1)COC2
InChIInChI=1S/C10H12O2/c1-7(11)8-2-3-9-5-12-6-10(9)4-8/h2-4,7,11H,5-6H2,1H3
InChIKeyCJWDCKMVJZTUHG-UHFFFAOYSA-N
XLogP1.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-Dimethylphenyl)ethanol
CID 21475
alpha,2,5-Trimethylbenzenemethanol
CID 118010
(1,3-Dihydro-2-benzofuran-5-yl)methanol
CID 19809558
7-Hydroxy-10-dehydroxydehydrodihydrobotr
CID 11402022
1-(3,4-Dimethylphenyl)ethanol
CID 36644
6,6,9-Trimethyl-3-pentyl-1,2,3,4-tetrahydrobenzo[c]chromen-1-ol
CID 521727
(2S,3R,4R,5S,6R)-2-(3-(4-Ethylphenyl)-1,3-dihydroisobenzofuran-5-yl)-6-(hydroxymethyl)-tetrahydro-2H-pyran-3,4,5-triol
CID 53380482
(1R)-1-(2,4-dimethylphenyl)ethan-1-ol
CID 10975666
cis-1,2-Dihydroxy-1,2-dihydro-7-hydroxymethylnaphthalene
CID 656878
(2R,3R,4R,5S)-2-[(1R)-1,2-dihydroxyethyl]-5-[3-[(4-ethylphenyl)methyl]-4-methylphenyl]oxolane-3,4-diol
CID 73346536
2-[(2R,5S)-5-methyl-5-(4-methylphenyl)oxolan-2-yl]propan-2-ol
CID 44240268
2-[(2S,5S)-5-methyl-5-(4-methylphenyl)oxolan-2-yl]propan-2-ol
CID 44583949

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol?
The IUPAC name of 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol (CID 63020955) is 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol.
What is the SMILES notation for 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol?
The canonical SMILES for 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol is CC(O)c1ccc2c(c1)COC2.
What is the InChIKey of 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol?
The InChIKey is CJWDCKMVJZTUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-7(11)8-2-3-9-5-12-6-10(9)4-8/h2-4,7,11H,5-6H2,1H3.
What are the key properties of 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol?
1-(1,3-dihydro-2-benzofuran-5-yl)ethanol has a molecular weight of 164.20 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dihydro-2-benzofuran-5-yl)ethanol is sourced from PubChem (CID 63020955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).