2-苯基苯基4-甲基苯-1-磺酸盐
TL;DR: 2-苯基苯基4-甲基苯-1-磺酸盐 (CAS 109471-79-6) is a chemical compound with molecular formula C19H16O3S and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯基苯基4-甲基苯-1-磺酸盐
(2-phenylphenyl) 4-methylbenzenesulfonate
Also Known As: 2-(Tosyloxy)biphenyl, 2-phenylphenyl 4-methylbenzene-1-sulfonate, biphenyl-2-yl 4-methylbenzenesulfonate, (2-phenylphenyl) 4-methylbenzenesulfonate, J2.369.178G
| Molecular Formula | C19H16O3S |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.082 |
| Heavy Atoms | 23 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 109471-79-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C3=CC=CC=C3 |
| InChIKey | BHGWQZFJVFVCCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-苯基苯基4-甲基苯-1-磺酸盐 (CAS 109471-79-6), with molecular formula C19H16O3S and molecular weight 324.08 g/mol. IUPAC: (2-phenylphenyl) 4-methylbenzenesulfonate.
Chemical Property Profile of 2-苯基苯基4-甲基苯-1-磺酸盐
Property Insights of 2-苯基苯基4-甲基苯-1-磺酸盐
The XLogP value of 5.0 indicates that 2-苯基苯基4-甲基苯-1-磺酸盐 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-苯基苯基4-甲基苯-1-磺酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-苯基苯基4-甲基苯-1-磺酸盐 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-苯基苯基4-甲基苯-1-磺酸盐?
The CAS number of 2-苯基苯基4-甲基苯-1-磺酸盐 is 109471-79-6.
What is the molecular formula of 2-苯基苯基4-甲基苯-1-磺酸盐?
The molecular formula of 2-苯基苯基4-甲基苯-1-磺酸盐 is C19H16O3S.
What is the molecular weight of 2-苯基苯基4-甲基苯-1-磺酸盐?
The molecular weight of 2-苯基苯基4-甲基苯-1-磺酸盐 is 324.08 g/mol.
Where can I buy 2-苯基苯基4-甲基苯-1-磺酸盐?
You can request a quote for 2-苯基苯基4-甲基苯-1-磺酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯基苯基4-甲基苯-1-磺酸盐?
Yes, KEHONG BIO provides custom synthesis services for 2-苯基苯基4-甲基苯-1-磺酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.