3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde
TL;DR: 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde (CAS 956352-08-2) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethylpyrazol-1-yl)benzaldehyde
Also Known As: 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde, 3-(3,5-dimethylpyrazol-1-yl)benzaldehyde, 3-(3,5-Dimethyl-pyrazol-1-yl)-benzaldehyde, 4356AF, BAS 10149216
| Molecular Formula | C12H12N2O |
|---|---|
| Molecular Weight | 200.09 g/mol |
| LogP | 2.30164 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.09496 |
| Heavy Atoms | 15 |
| Complexity | 500.07327 |
Chemical Identifiers
| CAS Number | 956352-08-2 |
|---|---|
| SMILES | CC1=CC(=NN1C2=CC=CC(=C2)C=O)C |
Product Overview
3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde (CAS 956352-08-2), with molecular formula C12H12N2O and molecular weight 200.09 g/mol. IUPAC: 3-(3,5-dimethylpyrazol-1-yl)benzaldehyde.
Chemical Property Profile of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde
Property Insights of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde
The XLogP value of 2.30164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde. With a topological polar surface area (TPSA) of 34.89 Ų, 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,5-dimethyl-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 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde?
The CAS number of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde is 956352-08-2.
What is the molecular formula of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde?
The molecular formula of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde is C12H12N2O.
What is the molecular weight of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde?
The molecular weight of 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde is 200.09 g/mol.
Where can I buy 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde?
You can request a quote for 3-(3,5-dimethyl-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 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-dimethyl-1H-pyrazol-1-yl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.