4-((Phenylsulphonyl)oxy)phthalic acid
TL;DR: 4-((Phenylsulphonyl)oxy)phthalic acid (CAS 51419-30-8) is a chemical compound with molecular formula C14H10O7S and molecular weight 322.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzenesulfonyloxy)phthalic acid
Also Known As: 4-((Phenylsulphonyl)oxy)phthalic acid, EINECS 257-194-7, 4-(benzenesulfonyloxy)phthalic acid, 4-[(PHENYLSULFONYL)OXY]PHTHALIC ACID, 4-[(phenylsulphonyl)oxy]phthalic acid
| Molecular Formula | C14H10O7S |
|---|---|
| Molecular Weight | 322.01 g/mol |
| LogP | 1.8507 |
| Topological Polar Surface Area | 117.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.0147 |
| Heavy Atoms | 22 |
| Complexity | 825.5248 |
Chemical Identifiers
| CAS Number | 51419-30-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)C(=O)O)C(=O)O |
Product Overview
4-((Phenylsulphonyl)oxy)phthalic acid (CAS 51419-30-8), with molecular formula C14H10O7S and molecular weight 322.01 g/mol. IUPAC: 4-(benzenesulfonyloxy)phthalic acid.
Chemical Property Profile of 4-((Phenylsulphonyl)oxy)phthalic acid
Property Insights of 4-((Phenylsulphonyl)oxy)phthalic acid
The XLogP value of 1.8507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((Phenylsulphonyl)oxy)phthalic acid. The TPSA of 117.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((Phenylsulphonyl)oxy)phthalic acid. Following Lipinski's Rule of Five, 4-((Phenylsulphonyl)oxy)phthalic acid has 2 hydrogen bond donor(s) and 5 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-((Phenylsulphonyl)oxy)phthalic acid?
The CAS number of 4-((Phenylsulphonyl)oxy)phthalic acid is 51419-30-8.
What is the molecular formula of 4-((Phenylsulphonyl)oxy)phthalic acid?
The molecular formula of 4-((Phenylsulphonyl)oxy)phthalic acid is C14H10O7S.
What is the molecular weight of 4-((Phenylsulphonyl)oxy)phthalic acid?
The molecular weight of 4-((Phenylsulphonyl)oxy)phthalic acid is 322.01 g/mol.
Where can I buy 4-((Phenylsulphonyl)oxy)phthalic acid?
You can request a quote for 4-((Phenylsulphonyl)oxy)phthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((Phenylsulphonyl)oxy)phthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((Phenylsulphonyl)oxy)phthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.