2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol

C18H14O4 — CID 71015748

IUPAC2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol
SMILESOc1ccc(O)c(-c2ccc(-c3cc(O)ccc3O)cc2)c1
InChIInChI=1S/C18H14O4/c19-13-5-7-17(21)15(9-13)11-1-2-12(4-3-11)16-10-14(20)6-8-18(16)22/h1-10,19-22H
InChIKeyGRNMPBPVIGOIRO-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.84
Rot. Bonds2

About 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol

2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol (PubChem CID 71015748) has the molecular formula C18H14O4 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol.

Molecular Properties

Compound Name2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol
PubChem CID71015748
Molecular FormulaC18H14O4
Molecular Weight294.31 g/mol
Exact Mass294.09
IUPAC Name2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol
SMILESOc1ccc(O)c(-c2ccc(-c3cc(O)ccc3O)cc2)c1
InChIInChI=1S/C18H14O4/c19-13-5-7-17(21)15(9-13)11-1-2-12(4-3-11)16-10-14(20)6-8-18(16)22/h1-10,19-22H
InChIKeyGRNMPBPVIGOIRO-UHFFFAOYSA-N
XLogP3.84
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol?
The IUPAC name of 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol (CID 71015748) is 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol.
What is the SMILES notation for 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol?
The canonical SMILES for 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol is Oc1ccc(O)c(-c2ccc(-c3cc(O)ccc3O)cc2)c1.
What is the InChIKey of 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol?
The InChIKey is GRNMPBPVIGOIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O4/c19-13-5-7-17(21)15(9-13)11-1-2-12(4-3-11)16-10-14(20)6-8-18(16)22/h1-10,19-22H.
What are the key properties of 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol?
2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol has a molecular weight of 294.31 g/mol, XLogP of 3.84, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,5-dihydroxyphenyl)phenyl]benzene-1,4-diol is sourced from PubChem (CID 71015748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).