Naphthalen-1-yl 4-chlorobenzenesulfonate
TL;DR: Naphthalen-1-yl 4-chlorobenzenesulfonate (CAS 60893-36-9) is a chemical compound with molecular formula C16H11ClO3S and molecular weight 318.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl 4-chlorobenzenesulfonate
Also Known As: naphthalen-1-yl 4-chlorobenzenesulfonate, 1-naphthyl4-chlorobenzenesulfonate, AN-652/11741173, A3089/0130704
| Molecular Formula | C16H11ClO3S |
|---|---|
| Molecular Weight | 318.01 g/mol |
| LogP | 4.2609 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.01175 |
| Heavy Atoms | 21 |
| Complexity | 881.54895 |
Chemical Identifiers
| CAS Number | 60893-36-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
Naphthalen-1-yl 4-chlorobenzenesulfonate (CAS 60893-36-9), with molecular formula C16H11ClO3S and molecular weight 318.01 g/mol. IUPAC: naphthalen-1-yl 4-chlorobenzenesulfonate.
Chemical Property Profile of Naphthalen-1-yl 4-chlorobenzenesulfonate
Property Insights of Naphthalen-1-yl 4-chlorobenzenesulfonate
The XLogP value of 4.2609 indicates that Naphthalen-1-yl 4-chlorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Naphthalen-1-yl 4-chlorobenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalen-1-yl 4-chlorobenzenesulfonate has 0 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 Naphthalen-1-yl 4-chlorobenzenesulfonate?
The CAS number of Naphthalen-1-yl 4-chlorobenzenesulfonate is 60893-36-9.
What is the molecular formula of Naphthalen-1-yl 4-chlorobenzenesulfonate?
The molecular formula of Naphthalen-1-yl 4-chlorobenzenesulfonate is C16H11ClO3S.
What is the molecular weight of Naphthalen-1-yl 4-chlorobenzenesulfonate?
The molecular weight of Naphthalen-1-yl 4-chlorobenzenesulfonate is 318.01 g/mol.
Where can I buy Naphthalen-1-yl 4-chlorobenzenesulfonate?
You can request a quote for Naphthalen-1-yl 4-chlorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalen-1-yl 4-chlorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Naphthalen-1-yl 4-chlorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.