Piperidin-4-ylmethyl acetate
TL;DR: Piperidin-4-ylmethyl acetate (CAS 500786-59-4) is a chemical compound with molecular formula C8H15NO2 and molecular weight 157.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperidin-4-ylmethyl acetate
Also Known As: piperidin-4-ylmethyl acetate, (piperidin-4-yl)methyl acetate, 4-Piperidinemethanol acetate, J2.775.045A
| Molecular Formula | C8H15NO2 |
|---|---|
| Molecular Weight | 157.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.11028 |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 500786-59-4 |
|---|---|
| SMILES | CC(=O)OCC1CCNCC1 |
| InChIKey | KQGBGOUNTHYCMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperidin-4-ylmethyl acetate (CAS 500786-59-4), with molecular formula C8H15NO2 and molecular weight 157.11 g/mol. IUPAC: piperidin-4-ylmethyl acetate.
Chemical Property Profile of Piperidin-4-ylmethyl acetate
Property Insights of Piperidin-4-ylmethyl acetate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidin-4-ylmethyl acetate. With a topological polar surface area (TPSA) of 38.3 Ų, Piperidin-4-ylmethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidin-4-ylmethyl acetate 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 Piperidin-4-ylmethyl acetate?
The CAS number of Piperidin-4-ylmethyl acetate is 500786-59-4.
What is the molecular formula of Piperidin-4-ylmethyl acetate?
The molecular formula of Piperidin-4-ylmethyl acetate is C8H15NO2.
What is the molecular weight of Piperidin-4-ylmethyl acetate?
The molecular weight of Piperidin-4-ylmethyl acetate is 157.11 g/mol.
Where can I buy Piperidin-4-ylmethyl acetate?
You can request a quote for Piperidin-4-ylmethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidin-4-ylmethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Piperidin-4-ylmethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.