Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride
TL;DR: Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride (CAS 1940-87-0) is a chemical compound with molecular formula C16H26ClNO4 and molecular weight 331.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2,6-dimethoxyphenoxy)-1-oxobutan-2-yl]-diethylazanium chloride
Also Known As: FC 655, 2-(Diethylamino)butyric acid 2,6-dimethoxyphenyl ester hydrochloride, BUTYRIC ACID, 2-(DIETHYLAMINO)-, 2,6-DIMETHOXYPHENYL ESTER, HYDROCHLORIDE, [1-(2,6-dimethoxyphenoxy)-1-oxobutan-2-yl]-diethylazanium chloride
| Molecular Formula | C16H26ClNO4 |
|---|---|
| Molecular Weight | 331.16 g/mol |
| LogP | -1.68 |
| Topological Polar Surface Area | 49.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 331.15503 |
| Heavy Atoms | 22 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 1940-87-0 |
|---|---|
| SMILES | CCC(C(=O)OC1=C(C=CC=C1OC)OC)[NH+](CC)CC.[Cl-] |
| InChIKey | PDGAXTWUAVXXSA-UHFFFAOYSA-N |
Product Overview
Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride (CAS 1940-87-0), with molecular formula C16H26ClNO4 and molecular weight 331.16 g/mol. IUPAC: [1-(2,6-dimethoxyphenoxy)-1-oxobutan-2-yl]-diethylazanium chloride.
Chemical Property Profile of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride
Property Insights of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride
The XLogP value of -1.68 indicates that Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.2 Ų, Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride 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 Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride?
The CAS number of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride is 1940-87-0.
What is the molecular formula of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride?
The molecular formula of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride is C16H26ClNO4.
What is the molecular weight of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride?
The molecular weight of Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride is 331.16 g/mol.
Where can I buy Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride?
You can request a quote for Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 2-(diethylamino)-, 2,6-dimethoxyphenyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.