methyl 4-(2-hydroxyphenyl)benzoate

C14H12O3 — CID 4564856

IUPACmethyl 4-(2-hydroxyphenyl)benzoate
SMILESCOC(=O)c1ccc(-c2ccccc2O)cc1
InChIInChI=1S/C14H12O3/c1-17-14(16)11-8-6-10(7-9-11)12-4-2-3-5-13(12)15/h2-9,15H,1H3
InChIKeyLFCLBBQKXWPXCX-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.85
Rot. Bonds2

About methyl 4-(2-hydroxyphenyl)benzoate

methyl 4-(2-hydroxyphenyl)benzoate (PubChem CID 4564856) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is methyl 4-(2-hydroxyphenyl)benzoate.

Molecular Properties

Compound Namemethyl 4-(2-hydroxyphenyl)benzoate
PubChem CID4564856
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Namemethyl 4-(2-hydroxyphenyl)benzoate
SMILESCOC(=O)c1ccc(-c2ccccc2O)cc1
InChIInChI=1S/C14H12O3/c1-17-14(16)11-8-6-10(7-9-11)12-4-2-3-5-13(12)15/h2-9,15H,1H3
InChIKeyLFCLBBQKXWPXCX-UHFFFAOYSA-N
XLogP2.85
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 4-(2-hydroxyphenyl)benzoate 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

methyl 4-hydroxy-3-phenylbenzoate
CID 15066016
methyl hydrogen carbonate;2-phenylphenol
CID 67829227
iron;methyl 4-(4-methoxycarbonylphenyl)benzoate
CID 159353152
methyl 4-(2-propanoylphenyl)benzoate
CID 174354570
methyl 3-bromo-5-(2-hydroxyphenyl)benzoate
CID 175028755
methyl 5-(2-hydroxyphenyl)pyridine-3-carboxylate
CID 117222190
ethyl 2-(4-methoxycarbonylphenyl)benzoate
CID 170872162
methyl 4-[2-(2-methoxyethoxy)phenyl]benzoate
CID 67257428
methyl 4-[2-(2-aminoethyl)phenyl]benzoate
CID 1393592
methyl 2-(4-acetylphenyl)-6-hydroxybenzoate
CID 102434886
(E)-3-[2-(4-methoxycarbonylphenyl)phenyl]prop-2-enoic acid
CID 170872378
methyl 2-phenylazulene-6-carboxylate
CID 23257786

Frequently Asked Questions

What is the IUPAC name of methyl 4-(2-hydroxyphenyl)benzoate?
The IUPAC name of methyl 4-(2-hydroxyphenyl)benzoate (CID 4564856) is methyl 4-(2-hydroxyphenyl)benzoate.
What is the SMILES notation for methyl 4-(2-hydroxyphenyl)benzoate?
The canonical SMILES for methyl 4-(2-hydroxyphenyl)benzoate is COC(=O)c1ccc(-c2ccccc2O)cc1.
What is the InChIKey of methyl 4-(2-hydroxyphenyl)benzoate?
The InChIKey is LFCLBBQKXWPXCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3/c1-17-14(16)11-8-6-10(7-9-11)12-4-2-3-5-13(12)15/h2-9,15H,1H3.
What are the key properties of methyl 4-(2-hydroxyphenyl)benzoate?
methyl 4-(2-hydroxyphenyl)benzoate has a molecular weight of 228.25 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(2-hydroxyphenyl)benzoate is sourced from PubChem (CID 4564856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).