4-Bromo-2-nitroindene-1,3-dione
TL;DR: 4-Bromo-2-nitroindene-1,3-dione (CAS 36231-02-4) is a chemical compound with molecular formula C9H4BrNO4 and molecular weight 268.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-nitroindene-1,3-dione
Also Known As: 4-Brom-2-nitroindan-1,3-dion, 4-bromo-2-nitroindene-1,3-dione
| Molecular Formula | C9H4BrNO4 |
|---|---|
| Molecular Weight | 268.93 g/mol |
| LogP | 1.4734 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.93237 |
| Heavy Atoms | 15 |
| Complexity | 496.88574 |
Chemical Identifiers
| CAS Number | 36231-02-4 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Br)C(=O)C(C2=O)[N+](=O)[O-] |
Product Overview
4-Bromo-2-nitroindene-1,3-dione (CAS 36231-02-4), with molecular formula C9H4BrNO4 and molecular weight 268.93 g/mol. IUPAC: 4-bromo-2-nitroindene-1,3-dione.
Chemical Property Profile of 4-Bromo-2-nitroindene-1,3-dione
Property Insights of 4-Bromo-2-nitroindene-1,3-dione
The XLogP value of 1.4734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-nitroindene-1,3-dione. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-nitroindene-1,3-dione. Following Lipinski's Rule of Five, 4-Bromo-2-nitroindene-1,3-dione has 0 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 4-Bromo-2-nitroindene-1,3-dione?
The CAS number of 4-Bromo-2-nitroindene-1,3-dione is 36231-02-4.
What is the molecular formula of 4-Bromo-2-nitroindene-1,3-dione?
The molecular formula of 4-Bromo-2-nitroindene-1,3-dione is C9H4BrNO4.
What is the molecular weight of 4-Bromo-2-nitroindene-1,3-dione?
The molecular weight of 4-Bromo-2-nitroindene-1,3-dione is 268.93 g/mol.
Where can I buy 4-Bromo-2-nitroindene-1,3-dione?
You can request a quote for 4-Bromo-2-nitroindene-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 4-Bromo-2-nitroindene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-nitroindene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.