methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate
TL;DR: methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate (CAS 313220-68-7) is a chemical compound with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(hydroxymethyl)-5-methylpyrazole-3-carboxylate
Also Known As: methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate, J1.590.131D, methyl 1-(hydroxymethyl)-5-methylpyrazole-3-carboxylate, 1-(Hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylic acid methyl ester, 1H-Pyrazole-3-carboxylicacid,1-(hydroxymethyl)-5-methyl-,methylester(9CI)
| Molecular Formula | C7H10N2O3 |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | -0.07208 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.06914 |
| Heavy Atoms | 12 |
| Complexity | 292.84164 |
Chemical Identifiers
| CAS Number | 313220-68-7 |
|---|---|
| SMILES | CC1=CC(=NN1CO)C(=O)OC |
Product Overview
methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate (CAS 313220-68-7), with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol. IUPAC: methyl 1-(hydroxymethyl)-5-methylpyrazole-3-carboxylate.
Chemical Property Profile of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate
Property Insights of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate
The XLogP value of -0.07208 indicates that methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate?
The CAS number of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate is 313220-68-7.
What is the molecular formula of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate?
The molecular formula of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate is C7H10N2O3.
What is the molecular weight of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate?
The molecular weight of methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate is 170.07 g/mol.
Where can I buy methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate?
You can request a quote for methyl 1-(hydroxymethyl)-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 methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 1-(hydroxymethyl)-5-methyl-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.