![2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- structure](/static/products/5128/512809-85-7.webp)
2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-
TL;DR: 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- (CAS 512809-85-7) is a chemical compound with molecular formula C9H6BrN3O5 and molecular weight 314.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-carboxylic acid
Also Known As: 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid, 5-((4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl)furan-2-carboxylic acid, 5-[(4-Bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furoic acid, 5-(4-Bromo-3-nitro-pyrazol-1-ylmethyl)-furan-2-carboxylic acid, 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-carboxylic acid
| Molecular Formula | C9H6BrN3O5 |
|---|---|
| Molecular Weight | 314.95 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.94907 |
| Heavy Atoms | 18 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 512809-85-7 |
|---|---|
| SMILES | C1=C(OC(=C1)C(=O)O)CN2C=C(C(=N2)[N+](=O)[O-])Br |
| InChIKey | RLWQKLOXFLKEPV-UHFFFAOYSA-N |
Product Overview
2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- (CAS 512809-85-7), with molecular formula C9H6BrN3O5 and molecular weight 314.95 g/mol. IUPAC: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-carboxylic acid.
Chemical Property Profile of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-
Property Insights of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-. Following Lipinski's Rule of Five, 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- has 1 hydrogen bond donor(s) and 6 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 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-?
The CAS number of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- is 512809-85-7.
What is the molecular formula of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-?
The molecular formula of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- is C9H6BrN3O5.
What is the molecular weight of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-?
The molecular weight of 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- is 314.95 g/mol.
Where can I buy 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-?
You can request a quote for 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 2-Furancarboxylic acid, 5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.