1,2,4,5-苯四甲腈
TL;DR: 1,2,4,5-苯四甲腈 (CAS 712-74-3) is a chemical compound with molecular formula C10H2N4 and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5-苯四甲腈
benzene-1,2,4,5-tetracarbonitrile
Also Known As: 1,2,4,5-Tetracyanobenzene, benzene-1,2,4,5-tetracarbonitrile, Tetracyanobenzene, Pyromellitonitrile, Pyromellitic nitrile
| Molecular Formula | C10H2N4 |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.02794 |
| Heavy Atoms | 14 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 712-74-3 |
|---|---|
| SMILES | C1=C(C(=CC(=C1C#N)C#N)C#N)C#N |
| InChIKey | FAAXSAZENACQBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,4,5-苯四甲腈 (CAS 712-74-3), with molecular formula C10H2N4 and molecular weight 178.03 g/mol. IUPAC: benzene-1,2,4,5-tetracarbonitrile.
Chemical Property Profile of 1,2,4,5-苯四甲腈
Property Insights of 1,2,4,5-苯四甲腈
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4,5-苯四甲腈. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4,5-苯四甲腈. Following Lipinski's Rule of Five, 1,2,4,5-苯四甲腈 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 1,2,4,5-苯四甲腈?
The CAS number of 1,2,4,5-苯四甲腈 is 712-74-3.
What is the molecular formula of 1,2,4,5-苯四甲腈?
The molecular formula of 1,2,4,5-苯四甲腈 is C10H2N4.
What is the molecular weight of 1,2,4,5-苯四甲腈?
The molecular weight of 1,2,4,5-苯四甲腈 is 178.03 g/mol.
Where can I buy 1,2,4,5-苯四甲腈?
You can request a quote for 1,2,4,5-苯四甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4,5-苯四甲腈?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4,5-苯四甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.