柠苹酸
TL;DR: 柠苹酸 (CAS 6236-10-8) is a chemical compound with molecular formula C5H6O5-2 and molecular weight 146.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
柠苹酸
(2R)-2-hydroxy-2-methylbutanedioate
Also Known As: D-Citramalate, (R)-citramalate, (R)-2-Methylmalate, (3R)-Citramalate, D-Citramalic acid
| Molecular Formula | C5H6O5-2 |
|---|---|
| Molecular Weight | 146.02 g/mol |
| LogP | -3.3727 |
| Topological Polar Surface Area | 100.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.02153 |
| Heavy Atoms | 10 |
| Complexity | 159.42125 |
Chemical Identifiers
| CAS Number | 6236-10-8 |
|---|---|
| SMILES | C[C@@](CC(=O)[O-])(C(=O)[O-])O |
Product Overview
柠苹酸 (CAS 6236-10-8), with molecular formula C5H6O5-2 and molecular weight 146.02 g/mol. IUPAC: (2R)-2-hydroxy-2-methylbutanedioate.
Chemical Property Profile of 柠苹酸
Property Insights of 柠苹酸
The XLogP value of -3.3727 indicates that 柠苹酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 100.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 柠苹酸. Following Lipinski's Rule of Five, 柠苹酸 has 1 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 柠苹酸?
The CAS number of 柠苹酸 is 6236-10-8.
What is the molecular formula of 柠苹酸?
The molecular formula of 柠苹酸 is C5H6O5-2.
What is the molecular weight of 柠苹酸?
The molecular weight of 柠苹酸 is 146.02 g/mol.
Where can I buy 柠苹酸?
You can request a quote for 柠苹酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 柠苹酸?
Yes, KEHONG BIO provides custom synthesis services for 柠苹酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.