2,3-Dibromo-1,4-dimethyl-5-nitrobenzene
TL;DR: 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene (CAS 15591-41-0) is a chemical compound with molecular formula C8H7Br2NO2 and molecular weight 306.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dibromo-1,4-dimethyl-5-nitrobenzene
Also Known As: 2,3-dibromo-1,4-dimethyl-5-nitrobenzene, 2,3-DIBROMO-5-NITRO-P-XYLENE, 2,3-dibromo-1,4-dimethyl-5-nitro-benzene, Benzene,2,3-dibromo-1,4-dimethyl-5-nitro-
| Molecular Formula | C8H7Br2NO2 |
|---|---|
| Molecular Weight | 306.88 g/mol |
| LogP | 3.73664 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.88434 |
| Heavy Atoms | 13 |
| Complexity | 376.89703 |
Chemical Identifiers
| CAS Number | 15591-41-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1Br)Br)C)[N+](=O)[O-] |
Product Overview
2,3-Dibromo-1,4-dimethyl-5-nitrobenzene (CAS 15591-41-0), with molecular formula C8H7Br2NO2 and molecular weight 306.88 g/mol. IUPAC: 2,3-dibromo-1,4-dimethyl-5-nitrobenzene.
Chemical Property Profile of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene
Property Insights of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene
The XLogP value of 3.73664 indicates that 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene has 0 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 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene?
The CAS number of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene is 15591-41-0.
What is the molecular formula of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene?
The molecular formula of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene is C8H7Br2NO2.
What is the molecular weight of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene?
The molecular weight of 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene is 306.88 g/mol.
Where can I buy 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene?
You can request a quote for 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dibromo-1,4-dimethyl-5-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.