Benzil, 2,2',4,4'-tetranitro-
TL;DR: Benzil, 2,2',4,4'-tetranitro- (CAS 15953-40-9) is a chemical compound with molecular formula C14H6N4O10 and molecular weight 390.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(2,4-dinitrophenyl)ethane-1,2-dione
Also Known As: Benzil, 2,2',4,4'-tetranitro-, Benzil,2',4,4'-tetranitro-, Benzil,2,2',4,4'-tetranitro, 1,2-bis(2,4-dinitrophenyl)ethane-1,2-dione, Bis(2,4-dinitrophenyl)ethane-1,2-dione
| Molecular Formula | C14H6N4O10 |
|---|---|
| Molecular Weight | 390.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 217.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.0084 |
| Heavy Atoms | 28 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 15953-40-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | YWLJLOLSGKXVKE-UHFFFAOYSA-N |
Product Overview
Benzil, 2,2',4,4'-tetranitro- (CAS 15953-40-9), with molecular formula C14H6N4O10 and molecular weight 390.01 g/mol. IUPAC: 1,2-bis(2,4-dinitrophenyl)ethane-1,2-dione.
Chemical Property Profile of Benzil, 2,2',4,4'-tetranitro-
Property Insights of Benzil, 2,2',4,4'-tetranitro-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzil, 2,2',4,4'-tetranitro-. The TPSA of 217.0 Ų indicates high polarity, suggesting Benzil, 2,2',4,4'-tetranitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzil, 2,2',4,4'-tetranitro- has 0 hydrogen bond donor(s) and 10 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 Benzil, 2,2',4,4'-tetranitro-?
The CAS number of Benzil, 2,2',4,4'-tetranitro- is 15953-40-9.
What is the molecular formula of Benzil, 2,2',4,4'-tetranitro-?
The molecular formula of Benzil, 2,2',4,4'-tetranitro- is C14H6N4O10.
What is the molecular weight of Benzil, 2,2',4,4'-tetranitro-?
The molecular weight of Benzil, 2,2',4,4'-tetranitro- is 390.01 g/mol.
Where can I buy Benzil, 2,2',4,4'-tetranitro-?
You can request a quote for Benzil, 2,2',4,4'-tetranitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzil, 2,2',4,4'-tetranitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzil, 2,2',4,4'-tetranitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.