5-ethoxy-2-methyl-1-benzofuran

C11H12O2 — CID 18726834

IUPAC5-ethoxy-2-methyl-1-benzofuran
SMILESCCOc1ccc2oc(C)cc2c1
InChIInChI=1S/C11H12O2/c1-3-12-10-4-5-11-9(7-10)6-8(2)13-11/h4-7H,3H2,1-2H3
InChIKeyGKPOOIMCWGIOBD-UHFFFAOYSA-N
MW176.21 g/mol
LogP3.14
Rot. Bonds2

About 5-ethoxy-2-methyl-1-benzofuran

5-ethoxy-2-methyl-1-benzofuran (PubChem CID 18726834) has the molecular formula C11H12O2 and a molecular weight of 176.21 g/mol. Its IUPAC name is 5-ethoxy-2-methyl-1-benzofuran.

Molecular Properties

Compound Name5-ethoxy-2-methyl-1-benzofuran
PubChem CID18726834
Molecular FormulaC11H12O2
Molecular Weight176.21 g/mol
Exact Mass176.08
IUPAC Name5-ethoxy-2-methyl-1-benzofuran
SMILESCCOc1ccc2oc(C)cc2c1
InChIInChI=1S/C11H12O2/c1-3-12-10-4-5-11-9(7-10)6-8(2)13-11/h4-7H,3H2,1-2H3
InChIKeyGKPOOIMCWGIOBD-UHFFFAOYSA-N
XLogP3.14
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-methyl-1-benzofuran?
The IUPAC name of 5-ethoxy-2-methyl-1-benzofuran (CID 18726834) is 5-ethoxy-2-methyl-1-benzofuran.
What is the SMILES notation for 5-ethoxy-2-methyl-1-benzofuran?
The canonical SMILES for 5-ethoxy-2-methyl-1-benzofuran is CCOc1ccc2oc(C)cc2c1.
What is the InChIKey of 5-ethoxy-2-methyl-1-benzofuran?
The InChIKey is GKPOOIMCWGIOBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O2/c1-3-12-10-4-5-11-9(7-10)6-8(2)13-11/h4-7H,3H2,1-2H3.
What are the key properties of 5-ethoxy-2-methyl-1-benzofuran?
5-ethoxy-2-methyl-1-benzofuran has a molecular weight of 176.21 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-methyl-1-benzofuran is sourced from PubChem (CID 18726834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).