奎宁酸
TL;DR: 奎宁酸 (CAS 36413-60-2) is a chemical compound with molecular formula C7H12O6 and molecular weight 192.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
奎宁酸
trans-(3S,5S)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
Also Known As: quinic acid, (+)-quinic acid, Kinic acid, (-)-quinic acid, BPBio1_001328
| Molecular Formula | C7H12O6 |
|---|---|
| Molecular Weight | 192.06 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.06339 |
| Heavy Atoms | 13 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 36413-60-2 |
|---|---|
| SMILES | C1[C@@H](C([C@H](CC1(C(=O)O)O)O)O)O |
| InChIKey | AAWZDTNXLSGCEK-ZHQZDSKASA-N |
Product Overview
奎宁酸 (CAS 36413-60-2), with molecular formula C7H12O6 and molecular weight 192.06 g/mol. IUPAC: trans-(3S,5S)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid.
Chemical Property Profile of 奎宁酸
Property Insights of 奎宁酸
The XLogP value of -2.4 indicates that 奎宁酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 奎宁酸. Following Lipinski's Rule of Five, 奎宁酸 has 5 hydrogen bond donor(s) and 6 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 奎宁酸?
The CAS number of 奎宁酸 is 36413-60-2.
What is the molecular formula of 奎宁酸?
The molecular formula of 奎宁酸 is C7H12O6.
What is the molecular weight of 奎宁酸?
The molecular weight of 奎宁酸 is 192.06 g/mol.
Where can I buy 奎宁酸?
You can request a quote for 奎宁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 奎宁酸?
Yes, KEHONG BIO provides custom synthesis services for 奎宁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.