4-Phenyl-4-piperidinecarboxaldehyde
TL;DR: 4-Phenyl-4-piperidinecarboxaldehyde (CAS 6952-94-9) is a chemical compound with molecular formula C12H15NO and molecular weight 189.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylpiperidine-4-carbaldehyde
Also Known As: 4-Phenylpiperidine-4-carbaldehyde, 4-Phenyl-4-piperidinecarboxaldehyde, 4-Fenil-4-formilpiperidina, 4-Piperidinecarboxaldehyde, 4-phenyl-, 4-phenyl-4-piperidinecarbaldehyde
| Molecular Formula | C12H15NO |
|---|---|
| Molecular Weight | 189.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.11537 |
| Heavy Atoms | 14 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 6952-94-9 |
|---|---|
| SMILES | C1CNCCC1(C=O)C2=CC=CC=C2 |
| InChIKey | XCENPWBBAXQVCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Phenyl-4-piperidinecarboxaldehyde (CAS 6952-94-9), with molecular formula C12H15NO and molecular weight 189.12 g/mol. IUPAC: 4-phenylpiperidine-4-carbaldehyde.
Chemical Property Profile of 4-Phenyl-4-piperidinecarboxaldehyde
Property Insights of 4-Phenyl-4-piperidinecarboxaldehyde
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenyl-4-piperidinecarboxaldehyde. With a topological polar surface area (TPSA) of 29.1 Ų, 4-Phenyl-4-piperidinecarboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenyl-4-piperidinecarboxaldehyde 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 4-Phenyl-4-piperidinecarboxaldehyde?
The CAS number of 4-Phenyl-4-piperidinecarboxaldehyde is 6952-94-9.
What is the molecular formula of 4-Phenyl-4-piperidinecarboxaldehyde?
The molecular formula of 4-Phenyl-4-piperidinecarboxaldehyde is C12H15NO.
What is the molecular weight of 4-Phenyl-4-piperidinecarboxaldehyde?
The molecular weight of 4-Phenyl-4-piperidinecarboxaldehyde is 189.12 g/mol.
Where can I buy 4-Phenyl-4-piperidinecarboxaldehyde?
You can request a quote for 4-Phenyl-4-piperidinecarboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenyl-4-piperidinecarboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenyl-4-piperidinecarboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.