![4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde structure](/static/products/849/849066-54-2.png)
4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde
TL;DR: 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde (CAS 849066-54-2) is a chemical compound with molecular formula C18H24N2O and molecular weight 284.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-ditert-butylpyrazol-1-yl)benzaldehyde
Also Known As: 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde, 4-(3,5-ditert-butylpyrazol-1-yl)benzaldehyde, 4-(3,5-di-tert-butylpyrazol-1-yl)benzaldehyde, 4-(3,5-Di-tert-butyl-1H-pyrazol-1-yl)benzaldehyde
| Molecular Formula | C18H24N2O |
|---|---|
| Molecular Weight | 284.19 g/mol |
| LogP | 4.2798 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.18887 |
| Heavy Atoms | 21 |
| Complexity | 637.3383 |
Chemical Identifiers
| CAS Number | 849066-54-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=NN1C2=CC=C(C=C2)C=O)C(C)(C)C |
Product Overview
4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde (CAS 849066-54-2), with molecular formula C18H24N2O and molecular weight 284.19 g/mol. IUPAC: 4-(3,5-ditert-butylpyrazol-1-yl)benzaldehyde.
Chemical Property Profile of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde
Property Insights of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde
The XLogP value of 4.2798 indicates that 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde has 0 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-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde?
The CAS number of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde is 849066-54-2.
What is the molecular formula of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde?
The molecular formula of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde is C18H24N2O.
What is the molecular weight of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde?
The molecular weight of 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde is 284.19 g/mol.
Where can I buy 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde?
You can request a quote for 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-[3,5-di(tert-butyl)-1H-pyrazol-1-yl]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.