1,2,3,5-苯四甲酸
TL;DR: 1,2,3,5-苯四甲酸 (CAS 479-47-0) is a chemical compound with molecular formula C10H6O8 and molecular weight 254.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,5-苯四甲酸
benzene-1,2,3,5-tetracarboxylic acid
Also Known As: prehnitic acid, benzene-1,2,3,5-tetracarboxylic acid, Mellanophanic acid, MELLOPHANIC ACID, 1,2,3,5-Benzene-tetracarboxylic acid
| Molecular Formula | C10H6O8 |
|---|---|
| Molecular Weight | 254.01 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.00627 |
| Heavy Atoms | 18 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 479-47-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O |
| InChIKey | NHDLVKOYPQPGNT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,5-苯四甲酸 (CAS 479-47-0), with molecular formula C10H6O8 and molecular weight 254.01 g/mol. IUPAC: benzene-1,2,3,5-tetracarboxylic acid.
Chemical Property Profile of 1,2,3,5-苯四甲酸
Property Insights of 1,2,3,5-苯四甲酸
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,5-苯四甲酸. The TPSA of 149.0 Ų indicates high polarity, suggesting 1,2,3,5-苯四甲酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2,3,5-苯四甲酸 has 4 hydrogen bond donor(s) and 8 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 1,2,3,5-苯四甲酸?
The CAS number of 1,2,3,5-苯四甲酸 is 479-47-0.
What is the molecular formula of 1,2,3,5-苯四甲酸?
The molecular formula of 1,2,3,5-苯四甲酸 is C10H6O8.
What is the molecular weight of 1,2,3,5-苯四甲酸?
The molecular weight of 1,2,3,5-苯四甲酸 is 254.01 g/mol.
Where can I buy 1,2,3,5-苯四甲酸?
You can request a quote for 1,2,3,5-苯四甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,5-苯四甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,5-苯四甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.