Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester
TL;DR: Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester (CAS 345258-77-7) is a chemical compound with molecular formula C14H11ClO4S and molecular weight 310.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-chlorophenyl)sulfonylphenyl] acetate
Also Known As: [4-(4-chlorophenyl)sulfonylphenyl] acetate|4-[(4-Chlorophenyl)sulfonyl]phenyl acetate #|Phenol, 4-(4-chlorophenylsulfonyl)-, acetate|ACETIC ACID 4-(4-CHLORO-BENZENESULFONYL)-PHENYL ESTER|GHVJTHRHDNVURK-UHFFFAOYSA-N
| Molecular Formula | C14H11ClO4S |
|---|---|
| Molecular Weight | 310.01 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.00665 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 345258-77-7 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)Cl |
| InChIKey | GHVJTHRHDNVURK-UHFFFAOYSA-N |
Product Overview
Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester (CAS 345258-77-7), with molecular formula C14H11ClO4S and molecular weight 310.01 g/mol. IUPAC: [4-(4-chlorophenyl)sulfonylphenyl] acetate.
Chemical Property Profile of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester
Property Insights of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester
The XLogP value of 3.0 indicates that Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester. Following Lipinski's Rule of Five, Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester 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 Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester?
The CAS number of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester is 345258-77-7.
What is the molecular formula of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester?
The molecular formula of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester is C14H11ClO4S.
What is the molecular weight of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester?
The molecular weight of Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester is 310.01 g/mol.
Where can I buy Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester?
You can request a quote for Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 4-(4-chloro-benzenesulfonyl)-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.