((4-溴-2-氯苯基)偶氮)丙二腈
TL;DR: ((4-溴-2-氯苯基)偶氮)丙二腈 (CAS 6017-38-5) is a chemical compound with molecular formula C9H4BrClN4 and molecular weight 281.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
((4-溴-2-氯苯基)偶氮)丙二腈
2-[(4-bromo-2-chlorophenyl)diazenyl]propanedinitrile
Also Known As: ((4-Bromo-2-chlorophenyl)azo)malononitrile, 2-Chlor-4-brom-phenyl-azo-malonitril, 2-Chlor-4-brom-phenyl-azo-malonitril [German], MALONONITRILE, ((4-BROMO-2-CHLOROPHENYL)AZO)-, 2-[(4-bromo-2-chlorophenyl)diazenyl]propanedinitrile
| Molecular Formula | C9H4BrClN4 |
|---|---|
| Molecular Weight | 281.93 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.9308 |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 6017-38-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)Cl)N=NC(C#N)C#N |
| InChIKey | VEOBSOXDWXSQIL-UHFFFAOYSA-N |
Product Overview
((4-溴-2-氯苯基)偶氮)丙二腈 (CAS 6017-38-5), with molecular formula C9H4BrClN4 and molecular weight 281.93 g/mol. IUPAC: 2-[(4-bromo-2-chlorophenyl)diazenyl]propanedinitrile.
Chemical Property Profile of ((4-溴-2-氯苯基)偶氮)丙二腈
Property Insights of ((4-溴-2-氯苯基)偶氮)丙二腈
The XLogP value of 3.2 indicates that ((4-溴-2-氯苯基)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 ((4-溴-2-氯苯基)偶氮)丙二腈. Following Lipinski's Rule of Five, ((4-溴-2-氯苯基)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 ((4-溴-2-氯苯基)偶氮)丙二腈?
The CAS number of ((4-溴-2-氯苯基)偶氮)丙二腈 is 6017-38-5.
What is the molecular formula of ((4-溴-2-氯苯基)偶氮)丙二腈?
The molecular formula of ((4-溴-2-氯苯基)偶氮)丙二腈 is C9H4BrClN4.
What is the molecular weight of ((4-溴-2-氯苯基)偶氮)丙二腈?
The molecular weight of ((4-溴-2-氯苯基)偶氮)丙二腈 is 281.93 g/mol.
Where can I buy ((4-溴-2-氯苯基)偶氮)丙二腈?
You can request a quote for ((4-溴-2-氯苯基)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 ((4-溴-2-氯苯基)偶氮)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for ((4-溴-2-氯苯基)偶氮)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.