Pantothenic Acid
TL;DR: Pantothenic Acid (CAS 79-83-4) is a chemical compound with molecular formula C9H17NO5 and molecular weight 219.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoic acid
Also Known As: pantothenic acid, D-pantothenic acid, vitamin B5, pantothenate, vitamin B3
| Molecular Formula | C9H17NO5 |
|---|---|
| Molecular Weight | 219.11 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 219.11067 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
| Melting Point | 195ºC (D-Calcium Pantothenate salt) |
| Solubility | Soluble |
Chemical Identifiers
| CAS Number | 79-83-4 |
|---|---|
| SMILES | CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O |
| InChIKey | GHOKWGTUZJEAQD-ZETCQYMHSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pantothenic Acid (CAS 79-83-4), with molecular formula C9H17NO5 and molecular weight 219.11 g/mol. IUPAC: 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoic acid.
Chemical Property Profile of Pantothenic Acid
Property Insights of Pantothenic Acid
The XLogP value of -1.1 indicates that Pantothenic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pantothenic Acid. Following Lipinski's Rule of Five, Pantothenic Acid has 4 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 Pantothenic Acid?
The CAS number of Pantothenic Acid is 79-83-4.
What is the molecular formula of Pantothenic Acid?
The molecular formula of Pantothenic Acid is C9H17NO5.
What is the molecular weight of Pantothenic Acid?
The molecular weight of Pantothenic Acid is 219.11 g/mol.
Where can I buy Pantothenic Acid?
You can request a quote for Pantothenic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pantothenic Acid?
Yes, KEHONG BIO provides custom synthesis services for Pantothenic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.