2-(furan-2-ylmethyl)benzene-1,4-diol

C11H10O3 — CID 11019639

IUPAC2-(furan-2-ylmethyl)benzene-1,4-diol
SMILESOc1ccc(O)c(Cc2ccco2)c1
InChIInChI=1S/C11H10O3/c12-9-3-4-11(13)8(6-9)7-10-2-1-5-14-10/h1-6,12-13H,7H2
InChIKeyXILYZMFMZQXKMC-UHFFFAOYSA-N
MW190.20 g/mol
LogP2.28
Rot. Bonds2

About 2-(furan-2-ylmethyl)benzene-1,4-diol

2-(furan-2-ylmethyl)benzene-1,4-diol (PubChem CID 11019639) has the molecular formula C11H10O3 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-(furan-2-ylmethyl)benzene-1,4-diol.

Molecular Properties

Compound Name2-(furan-2-ylmethyl)benzene-1,4-diol
PubChem CID11019639
Molecular FormulaC11H10O3
Molecular Weight190.20 g/mol
Exact Mass190.06
IUPAC Name2-(furan-2-ylmethyl)benzene-1,4-diol
SMILESOc1ccc(O)c(Cc2ccco2)c1
InChIInChI=1S/C11H10O3/c12-9-3-4-11(13)8(6-9)7-10-2-1-5-14-10/h1-6,12-13H,7H2
InChIKeyXILYZMFMZQXKMC-UHFFFAOYSA-N
XLogP2.28
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethyl)benzene-1,4-diol?
The IUPAC name of 2-(furan-2-ylmethyl)benzene-1,4-diol (CID 11019639) is 2-(furan-2-ylmethyl)benzene-1,4-diol.
What is the SMILES notation for 2-(furan-2-ylmethyl)benzene-1,4-diol?
The canonical SMILES for 2-(furan-2-ylmethyl)benzene-1,4-diol is Oc1ccc(O)c(Cc2ccco2)c1.
What is the InChIKey of 2-(furan-2-ylmethyl)benzene-1,4-diol?
The InChIKey is XILYZMFMZQXKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10O3/c12-9-3-4-11(13)8(6-9)7-10-2-1-5-14-10/h1-6,12-13H,7H2.
What are the key properties of 2-(furan-2-ylmethyl)benzene-1,4-diol?
2-(furan-2-ylmethyl)benzene-1,4-diol has a molecular weight of 190.20 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethyl)benzene-1,4-diol is sourced from PubChem (CID 11019639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).