Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid
TL;DR: Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid (CAS 66933-09-3) is a chemical compound with molecular formula C16H23NO5 and molecular weight 309.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropanoyloxymethyl 5-butoxypyridine-2-carboxylate
Also Known As: 5-Butoxypicolinic acid hydroxymethyl ester ester with pivalic acid, Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid, 2-Pyridinecarboxylic acid, 5-butoxy-, (2,2-dimethyl-1-oxopropoxy)methyl ester, 2,2-dimethylpropanoyloxymethyl 5-butoxypyridine-2-carboxylate, [(2,2-Dimethylpropanoyl)oxy]methyl 5-butoxypyridine-2-carboxylate
| Molecular Formula | C16H23NO5 |
|---|---|
| Molecular Weight | 309.16 g/mol |
| LogP | 2.9641 |
| Topological Polar Surface Area | 74.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 309.15762 |
| Heavy Atoms | 22 |
| Complexity | 490.25278 |
Chemical Identifiers
| CAS Number | 66933-09-3 |
|---|---|
| SMILES | CCCCOC1=CN=C(C=C1)C(=O)OCOC(=O)C(C)(C)C |
Product Overview
Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid (CAS 66933-09-3), with molecular formula C16H23NO5 and molecular weight 309.16 g/mol. IUPAC: 2,2-dimethylpropanoyloxymethyl 5-butoxypyridine-2-carboxylate.
Chemical Property Profile of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid
Property Insights of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid
The XLogP value of 2.9641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid. The TPSA of 74.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid. Following Lipinski's Rule of Five, Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid has 0 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 Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid?
The CAS number of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid is 66933-09-3.
What is the molecular formula of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid?
The molecular formula of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid is C16H23NO5.
What is the molecular weight of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid?
The molecular weight of Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid is 309.16 g/mol.
Where can I buy Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid?
You can request a quote for Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid?
Yes, KEHONG BIO provides custom synthesis services for Picolinic acid, 5-butoxy-, hydroxymethyl ester, ester with pivalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.