1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol

C14H12O3 — CID 83171940

IUPAC1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol
SMILESOC(Cc1ccco1)c1coc2ccccc12
InChIInChI=1S/C14H12O3/c15-13(8-10-4-3-7-16-10)12-9-17-14-6-2-1-5-11(12)14/h1-7,9,13,15H,8H2
InChIKeyIZLHXELRNFCDIZ-UHFFFAOYSA-N
MW228.25 g/mol
LogP3.30
Rot. Bonds3

About 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol

1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol (PubChem CID 83171940) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol.

Molecular Properties

Compound Name1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol
PubChem CID83171940
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Name1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol
SMILESOC(Cc1ccco1)c1coc2ccccc12
InChIInChI=1S/C14H12O3/c15-13(8-10-4-3-7-16-10)12-9-17-14-6-2-1-5-11(12)14/h1-7,9,13,15H,8H2
InChIKeyIZLHXELRNFCDIZ-UHFFFAOYSA-N
XLogP3.30
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-benzofuran-3-yl)-2-pyridin-2-ylethanol
CID 66458875
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
2-(furan-2-yl)-1-(4-phenylphenyl)ethanol
CID 83172274
1-(2,5-dimethylphenyl)-2-(furan-2-yl)ethanol
CID 83172156
2-(furan-2-yl)-1-(2-methylthiophen-3-yl)ethanol
CID 130581429
1-(2-fluoro-3-methylphenyl)-2-(furan-2-yl)ethanol
CID 115830188
2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanol
CID 83175177
1-[2-fluoro-5-(trifluoromethyl)phenyl]-2-(furan-2-yl)ethanol
CID 83176081
2-(furan-2-yl)-1-(4-methyl-3-pyridinyl)ethanol
CID 83171669
1-(1-benzofuran-3-yl)-2-methylpentan-1-ol
CID 107892766
2-(1-benzofuran-3-yl)propan-1-ol
CID 23614436
1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol
CID 83175179

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol?
The IUPAC name of 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol (CID 83171940) is 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol.
What is the SMILES notation for 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol?
The canonical SMILES for 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol is OC(Cc1ccco1)c1coc2ccccc12.
What is the InChIKey of 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol?
The InChIKey is IZLHXELRNFCDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3/c15-13(8-10-4-3-7-16-10)12-9-17-14-6-2-1-5-11(12)14/h1-7,9,13,15H,8H2.
What are the key properties of 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol?
1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol has a molecular weight of 228.25 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-3-yl)-2-(furan-2-yl)ethanol is sourced from PubChem (CID 83171940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).