2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol

C11H14O2 — CID 90443762

IUPAC2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol
SMILESCc1ccc2c(c1)OCC2CCO
InChIInChI=1S/C11H14O2/c1-8-2-3-10-9(4-5-12)7-13-11(10)6-8/h2-3,6,9,12H,4-5,7H2,1H3
InChIKeyYOQBXYHVLZFIKW-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.85
Rot. Bonds2

About 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol

2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol (PubChem CID 90443762) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol.

Molecular Properties

Compound Name2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol
PubChem CID90443762
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol
SMILESCc1ccc2c(c1)OCC2CCO
InChIInChI=1S/C11H14O2/c1-8-2-3-10-9(4-5-12)7-13-11(10)6-8/h2-3,6,9,12H,4-5,7H2,1H3
InChIKeyYOQBXYHVLZFIKW-UHFFFAOYSA-N
XLogP1.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol?
The IUPAC name of 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol (CID 90443762) is 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol.
What is the SMILES notation for 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol?
The canonical SMILES for 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol is Cc1ccc2c(c1)OCC2CCO.
What is the InChIKey of 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol?
The InChIKey is YOQBXYHVLZFIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-8-2-3-10-9(4-5-12)7-13-11(10)6-8/h2-3,6,9,12H,4-5,7H2,1H3.
What are the key properties of 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol?
2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol has a molecular weight of 178.23 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-2,3-dihydro-1-benzofuran-3-yl)ethanol is sourced from PubChem (CID 90443762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).