4-(Benzyloxy)phenyl 4-bromobenzenesulfonate
TL;DR: 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate (CAS 326885-08-9) is a chemical compound with molecular formula C19H15BrO4S and molecular weight 417.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylmethoxyphenyl) 4-bromobenzenesulfonate
Also Known As: 4-(benzyloxy)phenyl 4-bromobenzenesulfonate, (4-phenylmethoxyphenyl) 4-bromobenzenesulfonate, 4-(phenylmethoxy)phenyl 4-bromobenzenesulfonate, AN-698/41144618
| Molecular Formula | C19H15BrO4S |
|---|---|
| Molecular Weight | 417.99 g/mol |
| LogP | 4.7958 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.98743 |
| Heavy Atoms | 25 |
| Complexity | 921.4228 |
Chemical Identifiers
| CAS Number | 326885-08-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br |
Product Overview
4-(Benzyloxy)phenyl 4-bromobenzenesulfonate (CAS 326885-08-9), with molecular formula C19H15BrO4S and molecular weight 417.99 g/mol. IUPAC: (4-phenylmethoxyphenyl) 4-bromobenzenesulfonate.
Chemical Property Profile of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate
Property Insights of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate
The XLogP value of 4.7958 indicates that 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate has 0 hydrogen bond donor(s) and 4 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 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate?
The CAS number of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate is 326885-08-9.
What is the molecular formula of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate?
The molecular formula of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate is C19H15BrO4S.
What is the molecular weight of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate?
The molecular weight of 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate is 417.99 g/mol.
Where can I buy 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate?
You can request a quote for 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzyloxy)phenyl 4-bromobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.