4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol
TL;DR: 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol (CAS 94230-83-8) is a chemical compound with molecular formula C6H9BrN2O and molecular weight 203.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromo-3,5-dimethylpyrazol-1-yl)methanol
Also Known As: (4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methanol, (4-bromo-3,5-dimethylpyrazol-1-yl)methanol, 4-Bromo-3,5-dimethyl-1H-pyrazole-1-methanol, 4-Bromo-3,5-dimethylpyrazole-1-methanol, 4-Bromo-3,5-Dimethyl-1-Pyrazolemethanol
| Molecular Formula | C6H9BrN2O |
|---|---|
| Molecular Weight | 203.99 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.98982 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 94230-83-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CO)C)Br |
| InChIKey | ZPUHCXLBXSSWLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol (CAS 94230-83-8), with molecular formula C6H9BrN2O and molecular weight 203.99 g/mol. IUPAC: (4-bromo-3,5-dimethylpyrazol-1-yl)methanol.
Chemical Property Profile of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol
Property Insights of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol. With a topological polar surface area (TPSA) of 38.1 Ų, 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol 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 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol?
The CAS number of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol is 94230-83-8.
What is the molecular formula of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol?
The molecular formula of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol is C6H9BrN2O.
What is the molecular weight of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol?
The molecular weight of 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol is 203.99 g/mol.
Where can I buy 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol?
You can request a quote for 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-3,5-dimethyl-1H-pyrazole-1-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.