(4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate
TL;DR: (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate (CAS 17299-30-8) is a chemical compound with molecular formula C18H19ClO3S and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate
Also Known As: (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate, (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesu, 4-Chloro-5-methyl-2-(propan-2-yl)phenyl (E)-2-phenylethene-1-sulfonate
| Molecular Formula | C18H19ClO3S |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 5.15132 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.07434 |
| Heavy Atoms | 23 |
| Complexity | 809.6604 |
Chemical Identifiers
| CAS Number | 17299-30-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OS(=O)(=O)/C=C/C2=CC=CC=C2 |
Product Overview
(4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate (CAS 17299-30-8), with molecular formula C18H19ClO3S and molecular weight 350.07 g/mol. IUPAC: (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate.
Chemical Property Profile of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate
Property Insights of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate
The XLogP value of 5.15132 indicates that (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate?
The CAS number of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate is 17299-30-8.
What is the molecular formula of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate?
The molecular formula of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate is C18H19ClO3S.
What is the molecular weight of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate?
The molecular weight of (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate is 350.07 g/mol.
Where can I buy (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate?
You can request a quote for (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (4-chloro-5-methyl-2-propan-2-ylphenyl) (E)-2-phenylethenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.