4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl
TL;DR: 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl (CAS 69938-57-4) is a chemical compound with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-amino-5-methyl-2-nitrophenyl)-2-methyl-5-nitroaniline
Also Known As: 5,5'-dimethyl-2,2'-dinitrobenzidine, 4,4'-DIAMINO-3,3'-DIMETHYL-2,2'-DINITROBIPHENYL, 6,6 -Dinitro-3,3 -dimethylbenzidine, 4-(4-amino-5-methyl-2-nitro-phenyl)-2-methyl-5-nitro-aniline, 4-(4-amino-5-methyl-2-nitrophenyl)-2-methyl-5-nitroaniline
| Molecular Formula | C14H14N4O4 |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 2.95124 |
| Topological Polar Surface Area | 138.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.1015 |
| Heavy Atoms | 22 |
| Complexity | 734.4152 |
Chemical Identifiers
| CAS Number | 69938-57-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N)[N+](=O)[O-])C2=C(C=C(C(=C2)C)N)[N+](=O)[O-] |
Product Overview
4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl (CAS 69938-57-4), with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol. IUPAC: 4-(4-amino-5-methyl-2-nitrophenyl)-2-methyl-5-nitroaniline.
Chemical Property Profile of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl
Property Insights of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl
The XLogP value of 2.95124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl. The TPSA of 138.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl. Following Lipinski's Rule of Five, 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl has 2 hydrogen bond donor(s) and 6 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 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl?
The CAS number of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl is 69938-57-4.
What is the molecular formula of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl?
The molecular formula of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl is C14H14N4O4.
What is the molecular weight of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl?
The molecular weight of 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl is 302.10 g/mol.
Where can I buy 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl?
You can request a quote for 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Diamino-3,3'-dimethyl-2,2'-dinitrobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.