3,3'-Diacetylbenzidine
TL;DR: 3,3'-Diacetylbenzidine (CAS 98805-29-9) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(3-acetyl-4-aminophenyl)-2-aminophenyl]ethanone
Also Known As: 3,3'-Diacetylbenzidine, J1.285.710A, Ethanone, 1,1'-(4,4'-diamino(1,1'-biphenyl)-3,3'-diyl)bis-, 3,3 -Diacetyl-1,1 -biphenyl-4,4 -diamine, 1-[5-(3-acetyl-4-aminophenyl)-2-aminophenyl]ethanone
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 98805-29-9 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C(=O)C)N |
| InChIKey | OGWSSNXNTQBRKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Diacetylbenzidine (CAS 98805-29-9), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: 1-[5-(3-acetyl-4-aminophenyl)-2-aminophenyl]ethanone.
Chemical Property Profile of 3,3'-Diacetylbenzidine
Property Insights of 3,3'-Diacetylbenzidine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-Diacetylbenzidine. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Diacetylbenzidine. Following Lipinski's Rule of Five, 3,3'-Diacetylbenzidine has 2 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 3,3'-Diacetylbenzidine?
The CAS number of 3,3'-Diacetylbenzidine is 98805-29-9.
What is the molecular formula of 3,3'-Diacetylbenzidine?
The molecular formula of 3,3'-Diacetylbenzidine is C16H16N2O2.
What is the molecular weight of 3,3'-Diacetylbenzidine?
The molecular weight of 3,3'-Diacetylbenzidine is 268.12 g/mol.
Where can I buy 3,3'-Diacetylbenzidine?
You can request a quote for 3,3'-Diacetylbenzidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Diacetylbenzidine?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Diacetylbenzidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.