7,7,8,8-四氰基对苯二醌二甲烷
TL;DR: 7,7,8,8-四氰基对苯二醌二甲烷 (CAS 1518-16-7) is a chemical compound with molecular formula C12H4N4 and molecular weight 204.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,7,8,8-四氰基对苯二醌二甲烷
2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile
Also Known As: 7,7,8,8-Tetracyanoquinodimethane, TCNQ, Tetracyanoquinodimethane, Tetracyanoquinodimethan, Tetracyano-p-quinodimethane
| Molecular Formula | C12H4N4 |
|---|---|
| Molecular Weight | 204.04 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.0436 |
| Heavy Atoms | 16 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 1518-16-7 |
|---|---|
| SMILES | C1=CC(=C(C#N)C#N)C=CC1=C(C#N)C#N |
| InChIKey | PCCVSPMFGIFTHU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7,7,8,8-四氰基对苯二醌二甲烷 (CAS 1518-16-7), with molecular formula C12H4N4 and molecular weight 204.04 g/mol. IUPAC: 2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile.
Chemical Property Profile of 7,7,8,8-四氰基对苯二醌二甲烷
Property Insights of 7,7,8,8-四氰基对苯二醌二甲烷
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,7,8,8-四氰基对苯二醌二甲烷. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,7,8,8-四氰基对苯二醌二甲烷. Following Lipinski's Rule of Five, 7,7,8,8-四氰基对苯二醌二甲烷 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 7,7,8,8-四氰基对苯二醌二甲烷?
The CAS number of 7,7,8,8-四氰基对苯二醌二甲烷 is 1518-16-7.
What is the molecular formula of 7,7,8,8-四氰基对苯二醌二甲烷?
The molecular formula of 7,7,8,8-四氰基对苯二醌二甲烷 is C12H4N4.
What is the molecular weight of 7,7,8,8-四氰基对苯二醌二甲烷?
The molecular weight of 7,7,8,8-四氰基对苯二醌二甲烷 is 204.04 g/mol.
Where can I buy 7,7,8,8-四氰基对苯二醌二甲烷?
You can request a quote for 7,7,8,8-四氰基对苯二醌二甲烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,7,8,8-四氰基对苯二醌二甲烷?
Yes, KEHONG BIO provides custom synthesis services for 7,7,8,8-四氰基对苯二醌二甲烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.