Pentaric acid
TL;DR: Pentaric acid (CAS 488-31-3) is a chemical compound with molecular formula C5H8O7 and molecular weight 180.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trihydroxypentanedioic acid
Also Known As: pentaric acid, Ribaric acid, Arabinaric acid, 2,3,4-trihydroxypentanedioic acid, Disodium Ribarate
| Molecular Formula | C5H8O7 |
|---|---|
| Molecular Weight | 180.03 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.02701 |
| Heavy Atoms | 12 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 488-31-3 |
|---|---|
| SMILES | C(C(C(=O)O)O)(C(C(=O)O)O)O |
| InChIKey | NPTTZSYLTYJCPR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentaric acid (CAS 488-31-3), with molecular formula C5H8O7 and molecular weight 180.03 g/mol. IUPAC: 2,3,4-trihydroxypentanedioic acid.
Chemical Property Profile of Pentaric acid
Property Insights of Pentaric acid
The XLogP value of -2.5 indicates that Pentaric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentaric acid. Following Lipinski's Rule of Five, Pentaric acid has 5 hydrogen bond donor(s) and 7 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 Pentaric acid?
The CAS number of Pentaric acid is 488-31-3.
What is the molecular formula of Pentaric acid?
The molecular formula of Pentaric acid is C5H8O7.
What is the molecular weight of Pentaric acid?
The molecular weight of Pentaric acid is 180.03 g/mol.
Where can I buy Pentaric acid?
You can request a quote for Pentaric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentaric acid?
Yes, KEHONG BIO provides custom synthesis services for Pentaric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.