2-[2-(2-hydroxyphenyl)ethynyl]phenol

C14H10O2 — CID 10560378

IUPAC2-[2-(2-hydroxyphenyl)ethynyl]phenol
SMILESOc1ccccc1C#Cc1ccccc1O
InChIInChI=1S/C14H10O2/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16/h1-8,15-16H
InChIKeyQMBJQFMSLFYOJM-UHFFFAOYSA-N
MW210.23 g/mol
LogP2.50
Rot. Bonds

About 2-[2-(2-hydroxyphenyl)ethynyl]phenol

2-[2-(2-hydroxyphenyl)ethynyl]phenol (PubChem CID 10560378) has the molecular formula C14H10O2 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-[2-(2-hydroxyphenyl)ethynyl]phenol.

Molecular Properties

Compound Name2-[2-(2-hydroxyphenyl)ethynyl]phenol
PubChem CID10560378
Molecular FormulaC14H10O2
Molecular Weight210.23 g/mol
Exact Mass210.07
IUPAC Name2-[2-(2-hydroxyphenyl)ethynyl]phenol
SMILESOc1ccccc1C#Cc1ccccc1O
InChIInChI=1S/C14H10O2/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16/h1-8,15-16H
InChIKeyQMBJQFMSLFYOJM-UHFFFAOYSA-N
XLogP2.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-(2-hydroxyphenyl)ethynyl]phenyl]ethynyl]benzonitrile
CID 71419208
2-[2-(2-phenylphenyl)ethynyl]phenol
CID 166448690
2-[2-(4-methylphenyl)ethynyl]phenol
CID 20579578
2-(2-pyridin-4-ylethynyl)phenol
CID 175485114
2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol
CID 132557656
cyclodeca-2,4,6,8,10-pentaene-1,2-diol
CID 143742281
benzene-1,2-diol;hydrogen peroxide
CID 22924348
2-(2-cyclohexylethynyl)phenol
CID 57038623
2-[4-(methylamino)but-1-ynyl]phenol
CID 170463739
bicyclo[2.2.0]hexa-1,3,5-triene;2-ethynylphenol
CID 22327927
(2-phenylacetyl) 3-(2-hydroxyphenyl)prop-2-ynoate
CID 11380464
3-(2-naphthalen-1-ylethynyl)benzene-1,2-diol
CID 67420821

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyphenyl)ethynyl]phenol?
The IUPAC name of 2-[2-(2-hydroxyphenyl)ethynyl]phenol (CID 10560378) is 2-[2-(2-hydroxyphenyl)ethynyl]phenol.
What is the SMILES notation for 2-[2-(2-hydroxyphenyl)ethynyl]phenol?
The canonical SMILES for 2-[2-(2-hydroxyphenyl)ethynyl]phenol is Oc1ccccc1C#Cc1ccccc1O.
What is the InChIKey of 2-[2-(2-hydroxyphenyl)ethynyl]phenol?
The InChIKey is QMBJQFMSLFYOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O2/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16/h1-8,15-16H.
What are the key properties of 2-[2-(2-hydroxyphenyl)ethynyl]phenol?
2-[2-(2-hydroxyphenyl)ethynyl]phenol has a molecular weight of 210.23 g/mol, XLogP of 2.50, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyphenyl)ethynyl]phenol is sourced from PubChem (CID 10560378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).