2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid
TL;DR: 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid (CAS 101697-11-4) is a chemical compound with molecular formula C18H11ClO3 and molecular weight 310.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorobenzoyl)naphthalene-1-carboxylic acid
Also Known As: NCIOpen2_007898, 2-(4-chlorobenzoyl)-1-naphtoic acid, 2-(4-chlorobenzoyl)naphthalene-1-carboxylic acid
| Molecular Formula | C18H11ClO3 |
|---|---|
| Molecular Weight | 310.04 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.03967 |
| Heavy Atoms | 22 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 101697-11-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C(=O)O)C(=O)C3=CC=C(C=C3)Cl |
| InChIKey | AJXZPOQPSCXYOV-UHFFFAOYSA-N |
Product Overview
2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid (CAS 101697-11-4), with molecular formula C18H11ClO3 and molecular weight 310.04 g/mol. IUPAC: 2-(4-chlorobenzoyl)naphthalene-1-carboxylic acid.
Chemical Property Profile of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid
Property Insights of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid
The XLogP value of 4.7 indicates that 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid 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-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid?
The CAS number of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid is 101697-11-4.
What is the molecular formula of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid?
The molecular formula of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid is C18H11ClO3.
What is the molecular weight of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid?
The molecular weight of 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid is 310.04 g/mol.
Where can I buy 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid?
You can request a quote for 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorobenzoyl)naphthalene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.