ChemDiv1_025170
TL;DR: ChemDiv1_025170 (CAS 15538-88-2) is a chemical compound with molecular formula C16H6N4O4 and molecular weight 318.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dinitrofluoren-9-ylidene)propanedinitrile
Also Known As: ChemDiv1_025170, 2-(2,5-dinitrofluoren-9-ylidene)propanedinitrile, (2,5-dinitro-9H-fluoren-9-ylidene)propanedinitrile, Propanedinitrile, (2,5-dinitro-9H-fluoren-9-ylidene)-, (2,5-dinitrofluoren-9-ylidene)methane-1,1-dicarbonitrile
| Molecular Formula | C16H6N4O4 |
|---|---|
| Molecular Weight | 318.04 g/mol |
| LogP | 3.33246 |
| Topological Polar Surface Area | 133.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.0389 |
| Heavy Atoms | 24 |
| Complexity | 1025.0186 |
Chemical Identifiers
| CAS Number | 15538-88-2 |
|---|---|
| SMILES | C1=CC2=C(C3=C(C2=C(C#N)C#N)C=C(C=C3)[N+](=O)[O-])C(=C1)[N+](=O)[O-] |
Product Overview
ChemDiv1_025170 (CAS 15538-88-2), with molecular formula C16H6N4O4 and molecular weight 318.04 g/mol. IUPAC: 2-(2,5-dinitrofluoren-9-ylidene)propanedinitrile.
Chemical Property Profile of ChemDiv1_025170
Property Insights of ChemDiv1_025170
The XLogP value of 3.33246 indicates that ChemDiv1_025170 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_025170. Following Lipinski's Rule of Five, ChemDiv1_025170 has 0 hydrogen bond donor(s) and 6 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 ChemDiv1_025170?
The CAS number of ChemDiv1_025170 is 15538-88-2.
What is the molecular formula of ChemDiv1_025170?
The molecular formula of ChemDiv1_025170 is C16H6N4O4.
What is the molecular weight of ChemDiv1_025170?
The molecular weight of ChemDiv1_025170 is 318.04 g/mol.
Where can I buy ChemDiv1_025170?
You can request a quote for ChemDiv1_025170 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025170?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025170 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.