5-Bromo-6-nitroisoindoline-1,3-dione
TL;DR: 5-Bromo-6-nitroisoindoline-1,3-dione (CAS 64823-14-9) is a chemical compound with molecular formula C8H3BrN2O4 and molecular weight 269.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-6-nitroisoindole-1,3-dione
Also Known As: 5-Bromo-6-nitroisoindoline-1,3-dione, 5-bromo-6-nitroisoindole-1,3-dione, 4-Bromo-5-nitrophthalimide, 5-Bromo-6-nitro-isoindoline-1,3-dione, 5-bromo-6-nitro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C8H3BrN2O4 |
|---|---|
| Molecular Weight | 269.93 g/mol |
| LogP | 1.2409 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.9276 |
| Heavy Atoms | 15 |
| Complexity | 511.60828 |
Chemical Identifiers
| CAS Number | 64823-14-9 |
|---|---|
| SMILES | C1=C2C(=CC(=C1[N+](=O)[O-])Br)C(=O)NC2=O |
Product Overview
5-Bromo-6-nitroisoindoline-1,3-dione (CAS 64823-14-9), with molecular formula C8H3BrN2O4 and molecular weight 269.93 g/mol. IUPAC: 5-bromo-6-nitroisoindole-1,3-dione.
Chemical Property Profile of 5-Bromo-6-nitroisoindoline-1,3-dione
Property Insights of 5-Bromo-6-nitroisoindoline-1,3-dione
The XLogP value of 1.2409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-6-nitroisoindoline-1,3-dione. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-6-nitroisoindoline-1,3-dione. Following Lipinski's Rule of Five, 5-Bromo-6-nitroisoindoline-1,3-dione 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 5-Bromo-6-nitroisoindoline-1,3-dione?
The CAS number of 5-Bromo-6-nitroisoindoline-1,3-dione is 64823-14-9.
What is the molecular formula of 5-Bromo-6-nitroisoindoline-1,3-dione?
The molecular formula of 5-Bromo-6-nitroisoindoline-1,3-dione is C8H3BrN2O4.
What is the molecular weight of 5-Bromo-6-nitroisoindoline-1,3-dione?
The molecular weight of 5-Bromo-6-nitroisoindoline-1,3-dione is 269.93 g/mol.
Where can I buy 5-Bromo-6-nitroisoindoline-1,3-dione?
You can request a quote for 5-Bromo-6-nitroisoindoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-6-nitroisoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-6-nitroisoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.