2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester
TL;DR: 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester (CAS 27727-45-3) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 3-hydroxynaphthalene-2-carboxylate
Also Known As: benzyl 3-hydroxynaphthalene-2-carboxylate, 3-Hydroxy-2-naphthoic acid benzyl ester, J1.108.212B, 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester, 3-Hydroxy-2-naphthalenecarboxylic acid benzyl ester
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 3.9024 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 778.83026 |
Chemical Identifiers
| CAS Number | 27727-45-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C2=CC3=CC=CC=C3C=C2O |
Product Overview
2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester (CAS 27727-45-3), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: benzyl 3-hydroxynaphthalene-2-carboxylate.
Chemical Property Profile of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester
Property Insights of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester
The XLogP value of 3.9024 indicates that 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester 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 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester?
The CAS number of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester is 27727-45-3.
What is the molecular formula of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester?
The molecular formula of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester is C18H14O3.
What is the molecular weight of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester?
The molecular weight of 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester is 278.09 g/mol.
Where can I buy 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester?
You can request a quote for 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthalenecarboxylic acid, 3-hydroxy-, phenylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.