![7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one structure](/static/products/3270/327078-55-7.webp)
7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one
TL;DR: 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one (CAS 327078-55-7) is a chemical compound with molecular formula C13H7ClO3S and molecular weight 277.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-chlorophenyl)-5-hydroxy-1,3-benzoxathiol-2-one
Also Known As: 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one, 7-(4-chlorophenyl)-5-hydroxy-1,3-benzoxathiol-2-one, BAS 01163729, 7-(4-chlorophenyl)-5-hydroxy-2H-1,3-benzoxathiol-2-one, 7-(4-Chlorophenyl)-5-hydroxybenzo[d][1,3]oxathiol-2-one
| Molecular Formula | C13H7ClO3S |
|---|---|
| Molecular Weight | 277.98 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.98044 |
| Heavy Atoms | 18 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 327078-55-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C3C(=CC(=C2)O)SC(=O)O3)Cl |
| InChIKey | KWSFARAVCWJNKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one (CAS 327078-55-7), with molecular formula C13H7ClO3S and molecular weight 277.98 g/mol. IUPAC: 7-(4-chlorophenyl)-5-hydroxy-1,3-benzoxathiol-2-one.
Chemical Property Profile of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one
Property Insights of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one
The XLogP value of 4.2 indicates that 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one. Following Lipinski's Rule of Five, 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one has 1 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 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one?
The CAS number of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one is 327078-55-7.
What is the molecular formula of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one?
The molecular formula of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one is C13H7ClO3S.
What is the molecular weight of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one?
The molecular weight of 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one is 277.98 g/mol.
Where can I buy 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one?
You can request a quote for 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(4-Chloro-phenyl)-5-hydroxy-benzo[1,3]oxathiol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.