(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol

C11H14O3 — CID 126844412

IUPAC(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol
SMILESCCOc1cccc2c1OC(CO)C2
InChIInChI=1S/C11H14O3/c1-2-13-10-5-3-4-8-6-9(7-12)14-11(8)10/h3-5,9,12H,2,6-7H2,1H3
InChIKeyVXIULGVFJVJGIF-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.38
Rot. Bonds3

About (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol

(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol (PubChem CID 126844412) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol
PubChem CID126844412
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol
SMILESCCOc1cccc2c1OC(CO)C2
InChIInChI=1S/C11H14O3/c1-2-13-10-5-3-4-8-6-9(7-12)14-11(8)10/h3-5,9,12H,2,6-7H2,1H3
InChIKeyVXIULGVFJVJGIF-UHFFFAOYSA-N
XLogP1.38
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol?
The IUPAC name of (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol (CID 126844412) is (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol.
What is the SMILES notation for (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol?
The canonical SMILES for (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol is CCOc1cccc2c1OC(CO)C2.
What is the InChIKey of (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol?
The InChIKey is VXIULGVFJVJGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-2-13-10-5-3-4-8-6-9(7-12)14-11(8)10/h3-5,9,12H,2,6-7H2,1H3.
What are the key properties of (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol?
(7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol has a molecular weight of 194.23 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethoxy-2,3-dihydro-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 126844412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).