4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)
TL;DR: 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) (CAS 1702-16-5) is a chemical compound with molecular formula C15H28ClNO2 and molecular weight 289.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-piperidin-1-ium-1-ylcyclohexyl) butanoate chloride
Also Known As: BUTYRIC ACID, 4-PIPERIDINOCYCLOHEXYL ESTER, HYDROCHLORIDE, (4-piperidin-1-ium-1-ylcyclohexyl) butanoate chloride, Butanoic acid, 4-(1-piperidinyl)cyclohexyl ester, hydrochloride, (4-Piperidin-1-ium-1-ylcyclohexyl)butanoate chloride, 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)
| Molecular Formula | C15H28ClNO2 |
|---|---|
| Molecular Weight | 289.18 g/mol |
| LogP | -1.29 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.18085 |
| Heavy Atoms | 19 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 1702-16-5 |
|---|---|
| SMILES | CCCC(=O)OC1CCC(CC1)[NH+]2CCCCC2.[Cl-] |
| InChIKey | ZHPFAGYJSHHQBB-UHFFFAOYSA-N |
Product Overview
4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) (CAS 1702-16-5), with molecular formula C15H28ClNO2 and molecular weight 289.18 g/mol. IUPAC: (4-piperidin-1-ium-1-ylcyclohexyl) butanoate chloride.
Chemical Property Profile of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)
Property Insights of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)
The XLogP value of -1.29 indicates that 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) 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 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)?
The CAS number of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) is 1702-16-5.
What is the molecular formula of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)?
The molecular formula of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) is C15H28ClNO2.
What is the molecular weight of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)?
The molecular weight of 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) is 289.18 g/mol.
Where can I buy 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)?
You can request a quote for 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4-(Piperidin-1-yl)cyclohexyl butanoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.