![4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate structure](/static/products/725/72570-96-8.png)
4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate
TL;DR: 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate (CAS 72570-96-8) is a chemical compound with molecular formula C21H24O4S and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-3-oxonon-1-enyl]phenyl] benzenesulfonate
Also Known As: [4-[(E)-3-oxonon-1-enyl]phenyl] benzenesulfonate|4-[(1E)-3-OXONON-1-EN-1-YL]PHENYL BENZENESULFONATE
| Molecular Formula | C21H24O4S |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | 5.007 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 372.13953 |
| Heavy Atoms | 26 |
| Complexity | 822.07465 |
Chemical Identifiers
| CAS Number | 72570-96-8 |
|---|---|
| SMILES | CCCCCCC(=O)/C=C/C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2 |
Product Overview
4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate (CAS 72570-96-8), with molecular formula C21H24O4S and molecular weight 372.14 g/mol. IUPAC: [4-[(E)-3-oxonon-1-enyl]phenyl] benzenesulfonate.
Chemical Property Profile of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate
Property Insights of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate
The XLogP value of 5.007 indicates that 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate. Following Lipinski's Rule of Five, 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate?
The CAS number of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate is 72570-96-8.
What is the molecular formula of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate?
The molecular formula of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate is C21H24O4S.
What is the molecular weight of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate?
The molecular weight of 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate is 372.14 g/mol.
Where can I buy 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate?
You can request a quote for 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(1E)-3-Oxonon-1-EN-1-YL]phenyl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.