(4-溴-1-萘基偶氮)丙二腈
TL;DR: (4-溴-1-萘基偶氮)丙二腈 (CAS 6513-07-1) is a chemical compound with molecular formula C13H7BrN4 and molecular weight 297.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-溴-1-萘基偶氮)丙二腈
2-[(4-bromonaphthalen-1-yl)diazenyl]propanedinitrile
Also Known As: (4-Bromo-1-naphthylazo)malononitrile, 4-Brom-1-naphthyl-azo-malonitril, 4-Brom-1-naphthyl-azo-malonitril [German], F 2244, MALONONITRILE, (4-BROMO-1-NAPHTHYLAZO)-
| Molecular Formula | C13H7BrN4 |
|---|---|
| Molecular Weight | 297.99 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.9854 |
| Heavy Atoms | 18 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 6513-07-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2Br)N=NC(C#N)C#N |
| InChIKey | MEVIYQPHPRGOGJ-UHFFFAOYSA-N |
Product Overview
(4-溴-1-萘基偶氮)丙二腈 (CAS 6513-07-1), with molecular formula C13H7BrN4 and molecular weight 297.99 g/mol. IUPAC: 2-[(4-bromonaphthalen-1-yl)diazenyl]propanedinitrile.
Chemical Property Profile of (4-溴-1-萘基偶氮)丙二腈
Property Insights of (4-溴-1-萘基偶氮)丙二腈
The XLogP value of 3.9 indicates that (4-溴-1-萘基偶氮)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-1-萘基偶氮)丙二腈. Following Lipinski's Rule of Five, (4-溴-1-萘基偶氮)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-1-萘基偶氮)丙二腈?
The CAS number of (4-溴-1-萘基偶氮)丙二腈 is 6513-07-1.
What is the molecular formula of (4-溴-1-萘基偶氮)丙二腈?
The molecular formula of (4-溴-1-萘基偶氮)丙二腈 is C13H7BrN4.
What is the molecular weight of (4-溴-1-萘基偶氮)丙二腈?
The molecular weight of (4-溴-1-萘基偶氮)丙二腈 is 297.99 g/mol.
Where can I buy (4-溴-1-萘基偶氮)丙二腈?
You can request a quote for (4-溴-1-萘基偶氮)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-1-萘基偶氮)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for (4-溴-1-萘基偶氮)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.