((对溴苯基)偶氮)丙二腈
TL;DR: ((对溴苯基)偶氮)丙二腈 (CAS 5471-71-6) is a chemical compound with molecular formula C9H5BrN4 and molecular weight 247.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
((对溴苯基)偶氮)丙二腈
2-[(4-bromophenyl)diazenyl]propanedinitrile
Also Known As: ((p-Bromophenyl)azo)malononitrile, 4-Brom-phenyl-azo-malonitril, 4-Brom-phenyl-azo-malonitril [German], 2-[(4-bromophenyl)diazenyl]propanedinitrile, F 2208
| Molecular Formula | C9H5BrN4 |
|---|---|
| Molecular Weight | 247.97 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.96976 |
| Heavy Atoms | 14 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 5471-71-6 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC(C#N)C#N)Br |
| InChIKey | CIFOXOQVWXRACF-UHFFFAOYSA-N |
Product Overview
((对溴苯基)偶氮)丙二腈 (CAS 5471-71-6), with molecular formula C9H5BrN4 and molecular weight 247.97 g/mol. IUPAC: 2-[(4-bromophenyl)diazenyl]propanedinitrile.
Chemical Property Profile of ((对溴苯基)偶氮)丙二腈
Property Insights of ((对溴苯基)偶氮)丙二腈
The XLogP value of 3.4 indicates that ((对溴苯基)偶氮)丙二腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ((对溴苯基)偶氮)丙二腈. Following Lipinski's Rule of Five, ((对溴苯基)偶氮)丙二腈 has 0 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 ((对溴苯基)偶氮)丙二腈?
The CAS number of ((对溴苯基)偶氮)丙二腈 is 5471-71-6.
What is the molecular formula of ((对溴苯基)偶氮)丙二腈?
The molecular formula of ((对溴苯基)偶氮)丙二腈 is C9H5BrN4.
What is the molecular weight of ((对溴苯基)偶氮)丙二腈?
The molecular weight of ((对溴苯基)偶氮)丙二腈 is 247.97 g/mol.
Where can I buy ((对溴苯基)偶氮)丙二腈?
You can request a quote for ((对溴苯基)偶氮)丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((对溴苯基)偶氮)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for ((对溴苯基)偶氮)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.