5-(2-methoxyphenyl)furan-3-one

C11H10O3 — CID 12924090

IUPAC5-(2-methoxyphenyl)furan-3-one
SMILESCOc1ccccc1C1=CC(=O)CO1
InChIInChI=1S/C11H10O3/c1-13-10-5-3-2-4-9(10)11-6-8(12)7-14-11/h2-6H,7H2,1H3
InChIKeyRRQOAPFVAOIXHY-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.64
Rot. Bonds2

About 5-(2-methoxyphenyl)furan-3-one

5-(2-methoxyphenyl)furan-3-one (PubChem CID 12924090) has the molecular formula C11H10O3 and a molecular weight of 190.20 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)furan-3-one.

Molecular Properties

Compound Name5-(2-methoxyphenyl)furan-3-one
PubChem CID12924090
Molecular FormulaC11H10O3
Molecular Weight190.20 g/mol
Exact Mass190.06
IUPAC Name5-(2-methoxyphenyl)furan-3-one
SMILESCOc1ccccc1C1=CC(=O)CO1
InChIInChI=1S/C11H10O3/c1-13-10-5-3-2-4-9(10)11-6-8(12)7-14-11/h2-6H,7H2,1H3
InChIKeyRRQOAPFVAOIXHY-UHFFFAOYSA-N
XLogP1.64
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)furan-3-one?
The IUPAC name of 5-(2-methoxyphenyl)furan-3-one (CID 12924090) is 5-(2-methoxyphenyl)furan-3-one.
What is the SMILES notation for 5-(2-methoxyphenyl)furan-3-one?
The canonical SMILES for 5-(2-methoxyphenyl)furan-3-one is COc1ccccc1C1=CC(=O)CO1.
What is the InChIKey of 5-(2-methoxyphenyl)furan-3-one?
The InChIKey is RRQOAPFVAOIXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10O3/c1-13-10-5-3-2-4-9(10)11-6-8(12)7-14-11/h2-6H,7H2,1H3.
What are the key properties of 5-(2-methoxyphenyl)furan-3-one?
5-(2-methoxyphenyl)furan-3-one has a molecular weight of 190.20 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)furan-3-one is sourced from PubChem (CID 12924090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).