1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole
TL;DR: 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole (CAS 5635-98-3) is a chemical compound with molecular formula C11H9ClN2O2 and molecular weight 236.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazole-4-carbaldehyde
Also Known As: 1-(4'-chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole, J3.257.007K, AB00091427-01, 2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazole-4-carbaldehyde, 1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazole-4-carbaldehyde
| Molecular Formula | C11H9ClN2O2 |
|---|---|
| Molecular Weight | 236.04 g/mol |
| LogP | 1.93992 |
| Topological Polar Surface Area | 54.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.03525 |
| Heavy Atoms | 16 |
| Complexity | 581.0223 |
Chemical Identifiers
| CAS Number | 5635-98-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Cl)C=O |
Product Overview
1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole (CAS 5635-98-3), with molecular formula C11H9ClN2O2 and molecular weight 236.04 g/mol. IUPAC: 2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole
Property Insights of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole
The XLogP value of 1.93992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole. With a topological polar surface area (TPSA) of 54.86 Ų, 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole 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 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole?
The CAS number of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole is 5635-98-3.
What is the molecular formula of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole?
The molecular formula of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole is C11H9ClN2O2.
What is the molecular weight of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole?
The molecular weight of 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole is 236.04 g/mol.
Where can I buy 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole?
You can request a quote for 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4'-Chlorophenyl)-4-formyl-5-hydroxy-3-methylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.