Naphthalene-1-carboxylic acid phenyl ester
TL;DR: Naphthalene-1-carboxylic acid phenyl ester (CAS 36773-67-8) is a chemical compound with molecular formula C17H12O2 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl naphthalene-1-carboxylate
Also Known As: Phenyl 1-naphthoate, phenyl naphthoate, phenyl naphthalene-1-carboxylate, 1-Naphthoic acid phenyl ester, 1-Naphthalenecarboxylic acid, phenyl ester
| Molecular Formula | C17H12O2 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 4.059 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.08372 |
| Heavy Atoms | 19 |
| Complexity | 712.1734 |
Chemical Identifiers
| CAS Number | 36773-67-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)C2=CC=CC3=CC=CC=C32 |
Product Overview
Naphthalene-1-carboxylic acid phenyl ester (CAS 36773-67-8), with molecular formula C17H12O2 and molecular weight 248.08 g/mol. IUPAC: phenyl naphthalene-1-carboxylate.
Chemical Property Profile of Naphthalene-1-carboxylic acid phenyl ester
Property Insights of Naphthalene-1-carboxylic acid phenyl ester
The XLogP value of 4.059 indicates that Naphthalene-1-carboxylic acid phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Naphthalene-1-carboxylic acid phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalene-1-carboxylic acid phenyl ester has 0 hydrogen bond donor(s) and 2 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 Naphthalene-1-carboxylic acid phenyl ester?
The CAS number of Naphthalene-1-carboxylic acid phenyl ester is 36773-67-8.
What is the molecular formula of Naphthalene-1-carboxylic acid phenyl ester?
The molecular formula of Naphthalene-1-carboxylic acid phenyl ester is C17H12O2.
What is the molecular weight of Naphthalene-1-carboxylic acid phenyl ester?
The molecular weight of Naphthalene-1-carboxylic acid phenyl ester is 248.08 g/mol.
Where can I buy Naphthalene-1-carboxylic acid phenyl ester?
You can request a quote for Naphthalene-1-carboxylic acid phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalene-1-carboxylic acid phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Naphthalene-1-carboxylic acid phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.