1-Formyl-2-naphthyl 4-chlorobenzenesulfonate
TL;DR: 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate (CAS 431979-76-9) is a chemical compound with molecular formula C17H11ClO4S and molecular weight 346.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-formylnaphthalen-2-yl) 4-chlorobenzenesulfonate
Also Known As: 1-formyl-2-naphthyl 4-chlorobenzenesulfonate, 1-formylnaphthalen-2-yl 4-chlorobenzenesulfonate, 1-formylnaphthalen-2-yl 4-chlorobenzene-1-sulfonate, 1-formyl-2-naphthyl 4-chloro-1-benzenesulfonate, (1-formylnaphthalen-2-yl) 4-chlorobenzenesulfonate
| Molecular Formula | C17H11ClO4S |
|---|---|
| Molecular Weight | 346.01 g/mol |
| LogP | 4.0734 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.00665 |
| Heavy Atoms | 23 |
| Complexity | 979.15094 |
Chemical Identifiers
| CAS Number | 431979-76-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C=O)OS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
1-Formyl-2-naphthyl 4-chlorobenzenesulfonate (CAS 431979-76-9), with molecular formula C17H11ClO4S and molecular weight 346.01 g/mol. IUPAC: (1-formylnaphthalen-2-yl) 4-chlorobenzenesulfonate.
Chemical Property Profile of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate
Property Insights of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate
The XLogP value of 4.0734 indicates that 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate. Following Lipinski's Rule of Five, 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate has 0 hydrogen bond donor(s) and 4 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 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate?
The CAS number of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate is 431979-76-9.
What is the molecular formula of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate?
The molecular formula of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate is C17H11ClO4S.
What is the molecular weight of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate?
The molecular weight of 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate is 346.01 g/mol.
Where can I buy 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate?
You can request a quote for 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1-Formyl-2-naphthyl 4-chlorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.