ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate
TL;DR: ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate (CAS 70291-71-3) is a chemical compound with molecular formula C15H17N3O3 and molecular weight 287.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate
Also Known As: Ethyl 4-[(2Z)-2-(hydroxyimino)-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate, ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate
| Molecular Formula | C15H17N3O3 |
|---|---|
| Molecular Weight | 287.13 g/mol |
| LogP | 2.31582 |
| Topological Polar Surface Area | 87.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.12698 |
| Heavy Atoms | 21 |
| Complexity | 647.43835 |
Chemical Identifiers
| CAS Number | 70291-71-3 |
|---|---|
| SMILES | CCOC(=O)C1=NNC(=C1C/C(=N/O)/C2=CC=CC=C2)C |
Product Overview
ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate (CAS 70291-71-3), with molecular formula C15H17N3O3 and molecular weight 287.13 g/mol. IUPAC: ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate.
Chemical Property Profile of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate
Property Insights of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate
The XLogP value of 2.31582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate. The TPSA of 87.57 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate has 2 hydrogen bond donor(s) and 5 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 ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate?
The CAS number of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate is 70291-71-3.
What is the molecular formula of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate?
The molecular formula of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate is C15H17N3O3.
What is the molecular weight of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate?
The molecular weight of ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate is 287.13 g/mol.
Where can I buy ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate?
You can request a quote for ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(2Z)-2-hydroxyimino-2-phenylethyl]-5-methyl-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.