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Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate
TL;DR: Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate (CAS 773872-91-6) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-(hydroxymethyl)phenyl]benzoate
Also Known As: Methyl 4-[2-(hydroxymethyl)phenyl]benzoate, Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate, 2'-HYDROXYMETHYL-BIPHENYL-4-CARBOXYLIC ACID METHYL ESTER
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 2.6325 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 543.9201 |
Chemical Identifiers
| CAS Number | 773872-91-6 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2CO |
Product Overview
Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate (CAS 773872-91-6), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: methyl 4-[2-(hydroxymethyl)phenyl]benzoate.
Chemical Property Profile of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate
Property Insights of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate
The XLogP value of 2.6325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate. With a topological polar surface area (TPSA) of 46.53 Ų, Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate?
The CAS number of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate is 773872-91-6.
What is the molecular formula of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate?
The molecular formula of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate is C15H14O3.
What is the molecular weight of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate?
The molecular weight of Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate is 242.09 g/mol.
Where can I buy Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate?
You can request a quote for Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2'-(hydroxymethyl)-[1,1'-biphenyl]-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.