Isovaleric acid, 4-piperidinocyclohexyl ester
TL;DR: Isovaleric acid, 4-piperidinocyclohexyl ester (CAS 1532-04-3) is a chemical compound with molecular formula C16H29NO2 and molecular weight 267.21982 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-piperidin-1-ylcyclohexyl) 3-methylbutanoate
Also Known As: ISOVALERIC ACID, 4-PIPERIDINOCYCLOHEXYL ESTER, 4-Piperidinocyclohexanolisovalerate, Cyclohexanol, 4-piperidino-, isovalerate, 4-Piperidinocyclohexanol isovalerate, 4-Piperidinocyclohexyl ester of isovaleric acid
Technical Specifications
| Molecular Formula | C16H29NO2 |
| Molecular Weight | 267.21982 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.21982 Da |
| Heavy Atoms | 19 |
| Complexity | 276.0 |
| SMILES | CC(C)CC(=O)OC1CCC(CC1)N2CCCCC2 |
| InChIKey | IRYRSABDVVIVBD-UHFFFAOYSA-N |
Chemical Property Profile of Isovaleric acid, 4-piperidinocyclohexyl ester
Property Insights of Isovaleric acid, 4-piperidinocyclohexyl ester
The XLogP value of 3.6 indicates that Isovaleric acid, 4-piperidinocyclohexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Isovaleric acid, 4-piperidinocyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isovaleric acid, 4-piperidinocyclohexyl ester 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
What is the CAS number of Isovaleric acid, 4-piperidinocyclohexyl ester?
The CAS number of Isovaleric acid, 4-piperidinocyclohexyl ester is 1532-04-3.
What is the molecular formula of Isovaleric acid, 4-piperidinocyclohexyl ester?
The molecular formula of Isovaleric acid, 4-piperidinocyclohexyl ester is C16H29NO2.
What is the molecular weight of Isovaleric acid, 4-piperidinocyclohexyl ester?
The molecular weight of Isovaleric acid, 4-piperidinocyclohexyl ester is 267.21982 g/mol.
Where can I buy Isovaleric acid, 4-piperidinocyclohexyl ester?
You can request a quote for Isovaleric acid, 4-piperidinocyclohexyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isovaleric acid, 4-piperidinocyclohexyl ester?
Yes, CoreyChem provides custom synthesis services for Isovaleric acid, 4-piperidinocyclohexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.