4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol

C14H12O3 — CID 54294164

IUPAC4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol
SMILESOc1ccc(C=Cc2ccc(O)c(O)c2)cc1
InChIInChI=1S/C14H12O3/c15-12-6-3-10(4-7-12)1-2-11-5-8-13(16)14(17)9-11/h1-9,15-17H
InChIKeyRZPNUGYTWCJSIR-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.97
Rot. Bonds2

About 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol

4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol (PubChem CID 54294164) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol.

Molecular Properties

Compound Name4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol
PubChem CID54294164
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Name4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol
SMILESOc1ccc(C=Cc2ccc(O)c(O)c2)cc1
InChIInChI=1S/C14H12O3/c15-12-6-3-10(4-7-12)1-2-11-5-8-13(16)14(17)9-11/h1-9,15-17H
InChIKeyRZPNUGYTWCJSIR-UHFFFAOYSA-N
XLogP2.97
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol with MolForge

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

Launch Full Analysis

Related Compounds

4-[(E)-2-[4-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]phenyl]ethenyl]benzene-1,2-diol
CID 71680339
5-[(Z)-2-(3,4-dihydroxyphenyl)ethenyl]benzene-1,2,3-triol
CID 143585008
4-[2-[4-[[4-[2-(3,4-dihydroxyphenyl)ethenyl]phenyl]diazenyl]phenyl]ethenyl]benzene-1,2-diol
CID 136610654
4-(2-pyridin-4-ylethenyl)benzene-1,2-diol;hydrobromide
CID 173142705
4-[2-(2-hydroxyphenyl)ethenyl]benzene-1,2-diol
CID 54133293
4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2-methoxyphenol
CID 10377070
5-[2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol;methane
CID 74438837
4-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-N'-hydroxybenzenecarboximidamide
CID 175302476
4-[(E)-2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]ethenyl]phenol;triiodovanadium
CID 157160802
4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-(2-phenylethenyl)phenol
CID 157400568
methyl 4-[2-[4-[2-(3,4-dihydroxyphenyl)ethenyl]phenyl]ethenyl]benzoate
CID 68977211

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol?
The IUPAC name of 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol (CID 54294164) is 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol.
What is the SMILES notation for 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol?
The canonical SMILES for 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol is Oc1ccc(C=Cc2ccc(O)c(O)c2)cc1.
What is the InChIKey of 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol?
The InChIKey is RZPNUGYTWCJSIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3/c15-12-6-3-10(4-7-12)1-2-11-5-8-13(16)14(17)9-11/h1-9,15-17H.
What are the key properties of 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol?
4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol has a molecular weight of 228.25 g/mol, XLogP of 2.97, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol is sourced from PubChem (CID 54294164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).