1-Naphthyl 4-fluorobenzenesulfonate
TL;DR: 1-Naphthyl 4-fluorobenzenesulfonate (CAS 123412-32-8) is a chemical compound with molecular formula C16H11FO3S and molecular weight 302.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl 4-fluorobenzenesulfonate
Also Known As: 1-naphthyl 4-fluorobenzenesulfonate, 1-Naphthalenyl 4-fluorobenzenesulfonate, naphthalen-1-yl 4-fluorobenzenesulfonate, BAS 02106039, naphthalen-1-yl 4-fluorobenzene-1-sulfonate
| Molecular Formula | C16H11FO3S |
|---|---|
| Molecular Weight | 302.04 g/mol |
| LogP | 3.7466 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.0413 |
| Heavy Atoms | 21 |
| Complexity | 881.54895 |
Chemical Identifiers
| CAS Number | 123412-32-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)F |
Product Overview
1-Naphthyl 4-fluorobenzenesulfonate (CAS 123412-32-8), with molecular formula C16H11FO3S and molecular weight 302.04 g/mol. IUPAC: naphthalen-1-yl 4-fluorobenzenesulfonate.
Chemical Property Profile of 1-Naphthyl 4-fluorobenzenesulfonate
Property Insights of 1-Naphthyl 4-fluorobenzenesulfonate
The XLogP value of 3.7466 indicates that 1-Naphthyl 4-fluorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 1-Naphthyl 4-fluorobenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthyl 4-fluorobenzenesulfonate 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 1-Naphthyl 4-fluorobenzenesulfonate?
The CAS number of 1-Naphthyl 4-fluorobenzenesulfonate is 123412-32-8.
What is the molecular formula of 1-Naphthyl 4-fluorobenzenesulfonate?
The molecular formula of 1-Naphthyl 4-fluorobenzenesulfonate is C16H11FO3S.
What is the molecular weight of 1-Naphthyl 4-fluorobenzenesulfonate?
The molecular weight of 1-Naphthyl 4-fluorobenzenesulfonate is 302.04 g/mol.
Where can I buy 1-Naphthyl 4-fluorobenzenesulfonate?
You can request a quote for 1-Naphthyl 4-fluorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthyl 4-fluorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthyl 4-fluorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.