Bismark Brown
TL;DR: Bismark Brown (CAS 847026-63-5) is a chemical compound with molecular formula C12H13N5 and molecular weight 227.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-aminophenyl)diazenyl]benzene-1,2-diamine
Also Known As: Bismark Brown, 1,2-Benzenediamine, 3-((4-aminophenyl)azo)-, 3-[(e)-(4-aminophenyl)diazenyl]benzene-1,2-diamine, 3-[(4-aminophenyl)diazenyl]benzene-1,2-diamine, 1,2-Benzenediamine, 3-[2-(4-aminophenyl)diazenyl]-
| Molecular Formula | C12H13N5 |
|---|---|
| Molecular Weight | 227.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.1171 |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 847026-63-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)N=NC2=CC=C(C=C2)N)N)N |
| InChIKey | LBBAKTMYSIFTBS-UHFFFAOYSA-N |
Product Overview
Bismark Brown (CAS 847026-63-5), with molecular formula C12H13N5 and molecular weight 227.12 g/mol. IUPAC: 3-[(4-aminophenyl)diazenyl]benzene-1,2-diamine.
Chemical Property Profile of Bismark Brown
Property Insights of Bismark Brown
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bismark Brown. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bismark Brown. Following Lipinski's Rule of Five, Bismark Brown has 3 hydrogen bond donor(s) and 5 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 Bismark Brown?
The CAS number of Bismark Brown is 847026-63-5.
What is the molecular formula of Bismark Brown?
The molecular formula of Bismark Brown is C12H13N5.
What is the molecular weight of Bismark Brown?
The molecular weight of Bismark Brown is 227.12 g/mol.
Where can I buy Bismark Brown?
You can request a quote for Bismark Brown directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bismark Brown?
Yes, KEHONG BIO provides custom synthesis services for Bismark Brown and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.