betaine D-galacturonate
TL;DR: betaine D-galacturonate (CAS 93778-40-6) is a chemical compound with molecular formula C11H21NO9 and molecular weight 311.12164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
carboxymethyl(trimethyl)azanium;(2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoate
Also Known As: Betaine D-galacturonate, Carboxy-N,N,N-trimethylmethanaminium D-galacturonate, D-Galacturonic acid, ion(1-), 1-carboxy-N,N,N-trimethylmethanaminium, carboxymethyl(trimethyl)azanium; (2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoate, 298-176-9
Technical Specifications
| Molecular Formula | C11H21NO9 |
| Molecular Weight | 311.12164 g/mol |
| XLogP | -4.84 |
| Topological Polar Surface Area (TPSA) | 175.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.12164 Da |
| Heavy Atoms | 21 |
| Complexity | 279.0 |
| SMILES | C[N+](C)(C)CC(=O)O.C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)[O-])O)O)O)O |
| InChIKey | NTRGSJJAAMSXHU-RMTXHFLUSA-N |
Chemical Property Profile of betaine D-galacturonate
Property Insights of betaine D-galacturonate
The XLogP value of -4.84 indicates that betaine D-galacturonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting betaine D-galacturonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, betaine D-galacturonate has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of betaine D-galacturonate?
The CAS number of betaine D-galacturonate is 93778-40-6.
What is the molecular formula of betaine D-galacturonate?
The molecular formula of betaine D-galacturonate is C11H21NO9.
What is the molecular weight of betaine D-galacturonate?
The molecular weight of betaine D-galacturonate is 311.12164 g/mol.
Where can I buy betaine D-galacturonate?
You can request a quote for betaine D-galacturonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for betaine D-galacturonate?
Yes, CoreyChem provides custom synthesis services for betaine D-galacturonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.