![4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene structure](/static/products/521/5216-30-8.png)
4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
TL;DR: 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene (CAS 5216-30-8) is a chemical compound with molecular formula C14H17Cl2NO2 and molecular weight 301.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
Also Known As: 3,3'-Dichlorodiphenylacetylene, 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene, BIM-0014171.P001, Benzene, 1,1'-(1,2-ethynediyl)bis[3-chloro-, 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitro-benzene
| Molecular Formula | C14H17Cl2NO2 |
|---|---|
| Molecular Weight | 301.06 g/mol |
| LogP | 4.6286 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.06363 |
| Heavy Atoms | 19 |
| Complexity | 520.66754 |
Chemical Identifiers
| CAS Number | 5216-30-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)CC2CC2(Cl)Cl)[N+](=O)[O-] |
Product Overview
4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene (CAS 5216-30-8), with molecular formula C14H17Cl2NO2 and molecular weight 301.06 g/mol. IUPAC: 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene.
Chemical Property Profile of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
Property Insights of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
The XLogP value of 4.6286 indicates that 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-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, 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-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 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene?
The CAS number of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene is 5216-30-8.
What is the molecular formula of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene?
The molecular formula of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene is C14H17Cl2NO2.
What is the molecular weight of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene?
The molecular weight of 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene is 301.06 g/mol.
Where can I buy 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene?
You can request a quote for 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.