2-Naphthyl p-Toluenesulfonate
TL;DR: 2-Naphthyl p-Toluenesulfonate (CAS 967-35-1) is a chemical compound with molecular formula C17H14O3S and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl 4-methylbenzenesulfonate
Also Known As: 2-Naphthyl p-Toluenesulfonate, naphthalen-2-yl 4-methylbenzenesulfonate, 2-naphthyl tosylate, 2-Tosyloxynaphthalene, 2-(Tosyloxy)naphthalene
| Molecular Formula | C17H14O3S |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.06638 |
| Heavy Atoms | 21 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 967-35-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2 |
| InChIKey | CWCMQKWNHUXBFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Naphthyl p-Toluenesulfonate (CAS 967-35-1), with molecular formula C17H14O3S and molecular weight 298.07 g/mol. IUPAC: naphthalen-2-yl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-Naphthyl p-Toluenesulfonate
Property Insights of 2-Naphthyl p-Toluenesulfonate
The XLogP value of 4.6 indicates that 2-Naphthyl p-Toluenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Naphthyl p-Toluenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthyl p-Toluenesulfonate 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 2-Naphthyl p-Toluenesulfonate?
The CAS number of 2-Naphthyl p-Toluenesulfonate is 967-35-1.
What is the molecular formula of 2-Naphthyl p-Toluenesulfonate?
The molecular formula of 2-Naphthyl p-Toluenesulfonate is C17H14O3S.
What is the molecular weight of 2-Naphthyl p-Toluenesulfonate?
The molecular weight of 2-Naphthyl p-Toluenesulfonate is 298.07 g/mol.
Where can I buy 2-Naphthyl p-Toluenesulfonate?
You can request a quote for 2-Naphthyl p-Toluenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthyl p-Toluenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthyl p-Toluenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.