Choline, pantothenate
TL;DR: Choline, pantothenate (CAS 10030-88-3) is a chemical compound with molecular formula C14H30N2O6 and molecular weight 322.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;2-hydroxyethyl(trimethyl)azanium
Also Known As: Choline, pantothenate, EINECS 233-081-8, 2-Hydroxyethyltrimethylammonium (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alaninate, 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate; 2-hydroxyethyl(trimethyl)azanium, .beta.-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, ion(1-), (R)-, 2-hydroxy-N,N,N-trimethylethanaminium
| Molecular Formula | C14H30N2O6 |
|---|---|
| Molecular Weight | 322.21 g/mol |
| LogP | -2.6931 |
| Topological Polar Surface Area | 129.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 322.2104 |
| Heavy Atoms | 22 |
| Complexity | 338.715 |
Chemical Identifiers
| CAS Number | 10030-88-3 |
|---|---|
| SMILES | CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.C[N+](C)(C)CCO |
Product Overview
Choline, pantothenate (CAS 10030-88-3), with molecular formula C14H30N2O6 and molecular weight 322.21 g/mol. IUPAC: 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;2-hydroxyethyl(trimethyl)azanium.
Chemical Property Profile of Choline, pantothenate
Property Insights of Choline, pantothenate
The XLogP value of -2.6931 indicates that Choline, pantothenate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Choline, pantothenate. Following Lipinski's Rule of Five, Choline, pantothenate has 4 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 Choline, pantothenate?
The CAS number of Choline, pantothenate is 10030-88-3.
What is the molecular formula of Choline, pantothenate?
The molecular formula of Choline, pantothenate is C14H30N2O6.
What is the molecular weight of Choline, pantothenate?
The molecular weight of Choline, pantothenate is 322.21 g/mol.
Where can I buy Choline, pantothenate?
You can request a quote for Choline, pantothenate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Choline, pantothenate?
Yes, KEHONG BIO provides custom synthesis services for Choline, pantothenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.