Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-
TL;DR: Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- (CAS 91599-02-9) is a chemical compound with molecular formula C17H5N5O4 and molecular weight 343.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-cyano-2,7-dinitrofluoren-9-ylidene)propanedinitrile
Also Known As: BAS 00126550, Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-, 2-(4-cyano-2,7-dinitrofluoren-9-ylidene)propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)propanedinitrile, 2-(4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)malononitrile
| Molecular Formula | C17H5N5O4 |
|---|---|
| Molecular Weight | 343.03 g/mol |
| LogP | 3.20414 |
| Topological Polar Surface Area | 157.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.03415 |
| Heavy Atoms | 26 |
| Complexity | 1159.3503 |
Chemical Identifiers
| CAS Number | 91599-02-9 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C23)C#N)[N+](=O)[O-] |
Product Overview
Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- (CAS 91599-02-9), with molecular formula C17H5N5O4 and molecular weight 343.03 g/mol. IUPAC: 2-(4-cyano-2,7-dinitrofluoren-9-ylidene)propanedinitrile.
Chemical Property Profile of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-
Property Insights of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-
The XLogP value of 3.20414 indicates that Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.65 Ų indicates high polarity, suggesting Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- has 0 hydrogen bond donor(s) and 7 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 Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-?
The CAS number of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- is 91599-02-9.
What is the molecular formula of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-?
The molecular formula of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- is C17H5N5O4.
What is the molecular weight of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-?
The molecular weight of Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- is 343.03 g/mol.
Where can I buy Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-?
You can request a quote for Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Propanedinitrile, (4-cyano-2,7-dinitro-9H-fluoren-9-ylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.