Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride
TL;DR: Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride (CAS 2860-83-5) is a chemical compound with molecular formula C14H28ClNO2 and molecular weight 277.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ylethyl 2,2-dimethylpentanoate;hydrochloride
Also Known As: 2,2-Dimethylvaleric acid 2-piperidinoethyl ester hydrochloride, Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride, Pentanoic acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride, 2-(piperidin-1-yl)ethyl 2,2-dimethylpentanoate hydrochloride(1:1), 2-piperidin-1-ylethyl 2,2-dimethylpentanoate hydrochloride
| Molecular Formula | C14H28ClNO2 |
|---|---|
| Molecular Weight | 277.18 g/mol |
| LogP | 3.2636 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.18085 |
| Heavy Atoms | 18 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 2860-83-5 |
|---|---|
| SMILES | CCCC(C)(C)C(=O)OCCN1CCCCC1.Cl |
| InChIKey | FBIHMJAONMMITL-UHFFFAOYSA-N |
Product Overview
Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride (CAS 2860-83-5), with molecular formula C14H28ClNO2 and molecular weight 277.18 g/mol. IUPAC: 2-piperidin-1-ylethyl 2,2-dimethylpentanoate;hydrochloride.
Chemical Property Profile of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride
Property Insights of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride
The XLogP value of 3.2636 indicates that Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride has 1 hydrogen bond donor(s) and 3 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 Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride?
The CAS number of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride is 2860-83-5.
What is the molecular formula of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride?
The molecular formula of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride is C14H28ClNO2.
What is the molecular weight of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride?
The molecular weight of Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride is 277.18 g/mol.
Where can I buy Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride?
You can request a quote for Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 2,2-dimethyl-, 2-piperidinoethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.