Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride
TL;DR: Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride (CAS 78372-14-2) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpiperidin-4-yl) 3-methyl-2-phenylpentanoate;hydrochloride
Also Known As: C 4246, 3-Methyl-2-phenylvaleric acid 1-ethyl-4-piperidyl ester hydrochloride, 4-Piperidinol, 1-ethyl-, 3-methyl-2-phenylvalerate, hydrochloride, Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride, Benzeneacetic acid, alpha-(2-butyl)-, 1-ethyl-4-piperidyl ester, hydrochloride
| Molecular Formula | C19H30ClNO2 |
|---|---|
| Molecular Weight | 339.20 g/mol |
| LogP | 4.2656 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.1965 |
| Heavy Atoms | 23 |
| Complexity | 457.69724 |
Chemical Identifiers
| CAS Number | 78372-14-2 |
|---|---|
| SMILES | CCC(C)C(C1=CC=CC=C1)C(=O)OC2CCN(CC2)CC.Cl |
Product Overview
Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride (CAS 78372-14-2), with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol. IUPAC: (1-ethylpiperidin-4-yl) 3-methyl-2-phenylpentanoate;hydrochloride.
Chemical Property Profile of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride
Property Insights of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride
The XLogP value of 4.2656 indicates that Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride has 0 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, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride?
The CAS number of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride is 78372-14-2.
What is the molecular formula of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride?
The molecular formula of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride is C19H30ClNO2.
What is the molecular weight of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride?
The molecular weight of Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride is 339.20 g/mol.
Where can I buy Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride?
You can request a quote for Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl 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, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 3-methyl-2-phenyl-, 1-ethyl-4-piperidyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.