(6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate
TL;DR: (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate (CAS 411219-20-0) is a chemical compound with molecular formula C17H13BrO3S and molecular weight 375.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-bromonaphthalen-2-yl) 4-methylbenzenesulfonate
Also Known As: 6-bromo-2-naphthyl4-methylbenzenesulfonate, (6-bromonaphthalen-2-yl) 4-methylbenzenesulfonate, 6-bromonaphthalen-2-yl 4-methylbenzene-1-sulfonate, AN-652/42476797
| Molecular Formula | C17H13BrO3S |
|---|---|
| Molecular Weight | 375.98 g/mol |
| LogP | 4.67842 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.97687 |
| Heavy Atoms | 22 |
| Complexity | 931.7802 |
Chemical Identifiers
| CAS Number | 411219-20-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br |
Product Overview
(6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate (CAS 411219-20-0), with molecular formula C17H13BrO3S and molecular weight 375.98 g/mol. IUPAC: (6-bromonaphthalen-2-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate
Property Insights of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate
The XLogP value of 4.67842 indicates that (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate 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 (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate?
The CAS number of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate is 411219-20-0.
What is the molecular formula of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate?
The molecular formula of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate is C17H13BrO3S.
What is the molecular weight of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate?
The molecular weight of (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate is 375.98 g/mol.
Where can I buy (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate?
You can request a quote for (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (6-Bromonaphthalen-2-yl) 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.