2-(phenoxymethyl)-2H-furan-5-one

C11H10O3 — CID 11275514

IUPAC2-(phenoxymethyl)-2H-furan-5-one
SMILESO=C1C=CC(COc2ccccc2)O1
InChIInChI=1S/C11H10O3/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7,10H,8H2
InChIKeyJWAQVVXDEICTTP-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.55
Rot. Bonds3

About 2-(phenoxymethyl)-2H-furan-5-one

2-(phenoxymethyl)-2H-furan-5-one (PubChem CID 11275514) has the molecular formula C11H10O3 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-(phenoxymethyl)-2H-furan-5-one.

Molecular Properties

Compound Name2-(phenoxymethyl)-2H-furan-5-one
PubChem CID11275514
Molecular FormulaC11H10O3
Molecular Weight190.20 g/mol
Exact Mass190.06
IUPAC Name2-(phenoxymethyl)-2H-furan-5-one
SMILESO=C1C=CC(COc2ccccc2)O1
InChIInChI=1S/C11H10O3/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7,10H,8H2
InChIKeyJWAQVVXDEICTTP-UHFFFAOYSA-N
XLogP1.55
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(phenoxymethyl)-2H-furan-5-one?
The IUPAC name of 2-(phenoxymethyl)-2H-furan-5-one (CID 11275514) is 2-(phenoxymethyl)-2H-furan-5-one.
What is the SMILES notation for 2-(phenoxymethyl)-2H-furan-5-one?
The canonical SMILES for 2-(phenoxymethyl)-2H-furan-5-one is O=C1C=CC(COc2ccccc2)O1.
What is the InChIKey of 2-(phenoxymethyl)-2H-furan-5-one?
The InChIKey is JWAQVVXDEICTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10O3/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7,10H,8H2.
What are the key properties of 2-(phenoxymethyl)-2H-furan-5-one?
2-(phenoxymethyl)-2H-furan-5-one has a molecular weight of 190.20 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxymethyl)-2H-furan-5-one is sourced from PubChem (CID 11275514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).