N-甲酰基哌啶
TL;DR: N-甲酰基哌啶 (CAS 2591-86-8) is a chemical compound with molecular formula C6H11NO and molecular weight 113.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-甲酰基哌啶
piperidine-1-carbaldehyde
Also Known As: N-Formylpiperidine, piperidine-1-carbaldehyde, 1-Formylpiperidine, Formylpiperidine, 1-Piperidinecarboxaldehyde
| Molecular Formula | C6H11NO |
|---|---|
| Molecular Weight | 113.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 113.08406 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
| Melting Point | -30.8 °C |
| Boiling Point | 222.5 °C @760 [mm Hg] |
| Density | 1.019 @25 °C |
Chemical Identifiers
| CAS Number | 2591-86-8 |
|---|---|
| SMILES | C1CCN(CC1)C=O |
| InChIKey | FEWLNYSYJNLUOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-甲酰基哌啶 (CAS 2591-86-8), with molecular formula C6H11NO and molecular weight 113.08 g/mol. IUPAC: piperidine-1-carbaldehyde.
Chemical Property Profile of N-甲酰基哌啶
Property Insights of N-甲酰基哌啶
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-甲酰基哌啶. With a topological polar surface area (TPSA) of 20.3 Ų, N-甲酰基哌啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-甲酰基哌啶 has 0 hydrogen bond donor(s) and 1 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 N-甲酰基哌啶?
The CAS number of N-甲酰基哌啶 is 2591-86-8.
What is the molecular formula of N-甲酰基哌啶?
The molecular formula of N-甲酰基哌啶 is C6H11NO.
What is the molecular weight of N-甲酰基哌啶?
The molecular weight of N-甲酰基哌啶 is 113.08 g/mol.
Where can I buy N-甲酰基哌啶?
You can request a quote for N-甲酰基哌啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-甲酰基哌啶?
Yes, KEHONG BIO provides custom synthesis services for N-甲酰基哌啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.