1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-
TL;DR: 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- (CAS 13369-77-2) is a chemical compound with molecular formula C6H5Br3N2 and molecular weight 341.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-tribromo-1-prop-2-enylpyrazole
Also Known As: 1-ALLYL-3,4,5-TRIBROMOPYRAZOLE, 1-Allyl-3,4,5-tribromo-1H-pyrazole, 3,4,5-tribromo-1-prop-2-enylpyrazole, 3,4,5-tribromo-1-prop-2-enyl-pyrazole, 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-
| Molecular Formula | C6H5Br3N2 |
|---|---|
| Molecular Weight | 341.80 g/mol |
| LogP | 3.3566 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.8003 |
| Heavy Atoms | 11 |
| Complexity | 279.5999 |
Chemical Identifiers
| CAS Number | 13369-77-2 |
|---|---|
| SMILES | C=CCN1C(=C(C(=N1)Br)Br)Br |
Product Overview
1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- (CAS 13369-77-2), with molecular formula C6H5Br3N2 and molecular weight 341.80 g/mol. IUPAC: 3,4,5-tribromo-1-prop-2-enylpyrazole.
Chemical Property Profile of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-
Property Insights of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-
The XLogP value of 3.3566 indicates that 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- has 0 hydrogen bond donor(s) and 1 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 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-?
The CAS number of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- is 13369-77-2.
What is the molecular formula of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-?
The molecular formula of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- is C6H5Br3N2.
What is the molecular weight of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-?
The molecular weight of 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- is 341.80 g/mol.
Where can I buy 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-?
You can request a quote for 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 3,4,5-tribromo-1-(2-propen-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.