1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene
TL;DR: 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene (CAS 122947-54-0) is a chemical compound with molecular formula C7H3Cl4NO2 and molecular weight 272.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dichloro-3-(dichloromethyl)-2-nitrobenzene
Also Known As: 1,5-dichloro-3-dichloromethyl-2-nitro-benzene, 1,5-Dichlor-3-dichlormethyl-2-nitro-benzol, 1,5-dichloro-3-(dichloromethyl)-2-nitrobenzene
| Molecular Formula | C7H3Cl4NO2 |
|---|---|
| Molecular Weight | 272.89 g/mol |
| LogP | 4.3778 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.89178 |
| Heavy Atoms | 14 |
| Complexity | 380.1977 |
Chemical Identifiers
| CAS Number | 122947-54-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(Cl)Cl)[N+](=O)[O-])Cl)Cl |
Product Overview
1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene (CAS 122947-54-0), with molecular formula C7H3Cl4NO2 and molecular weight 272.89 g/mol. IUPAC: 1,5-dichloro-3-(dichloromethyl)-2-nitrobenzene.
Chemical Property Profile of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene
Property Insights of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene
The XLogP value of 4.3778 indicates that 1,5-Dichloro-3-(dichloromethyl)-2-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, 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dichloro-3-(dichloromethyl)-2-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 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene?
The CAS number of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene is 122947-54-0.
What is the molecular formula of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene?
The molecular formula of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene is C7H3Cl4NO2.
What is the molecular weight of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene?
The molecular weight of 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene is 272.89 g/mol.
Where can I buy 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene?
You can request a quote for 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dichloro-3-(dichloromethyl)-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.