石榴碱
TL;DR: 石榴碱 (CAS 2858-66-4) is a chemical compound with molecular formula C8H15NO and molecular weight 141.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
石榴碱
1-[(2R)-piperidin-2-yl]propan-2-one
Also Known As: Pelletierine, Punicine, (-)-Pelletierine, (R)-Pelletierine, 2-Acetonylpiperidine
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.12 g/mol |
| LogP | 1.1076 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 116.426 |
Chemical Identifiers
| CAS Number | 2858-66-4 |
|---|---|
| SMILES | CC(=O)C[C@H]1CCCCN1 |
Product Overview
石榴碱 (CAS 2858-66-4), with molecular formula C8H15NO and molecular weight 141.12 g/mol. IUPAC: 1-[(2R)-piperidin-2-yl]propan-2-one.
Chemical Property Profile of 石榴碱
Property Insights of 石榴碱
The XLogP value of 1.1076 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 石榴碱. With a topological polar surface area (TPSA) of 29.1 Ų, 石榴碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 石榴碱 has 1 hydrogen bond donor(s) and 2 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 石榴碱?
The CAS number of 石榴碱 is 2858-66-4.
What is the molecular formula of 石榴碱?
The molecular formula of 石榴碱 is C8H15NO.
What is the molecular weight of 石榴碱?
The molecular weight of 石榴碱 is 141.12 g/mol.
Where can I buy 石榴碱?
You can request a quote for 石榴碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 石榴碱?
Yes, KEHONG BIO provides custom synthesis services for 石榴碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.