Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-
TL;DR: Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- (CAS 87001-92-1) is a chemical compound with molecular formula C14H7F5N2O5 and molecular weight 378.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentafluoro-6-[(2-methyl-4,6-dinitrophenoxy)methyl]benzene
Also Known As: Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-, 1,2,3,4,5-pentafluoro-6-[(2-methyl-4,6-dinitrophenoxy)methyl]benzene, 1,2,3,4,5-pentafluoro-6-[(2-methyl-4,6-dinitro-phenoxy)methyl]benzene, Benzene,1,2,3,4,5-pentafluoro-6-[(2-methyl-4,6-dinitrophenoxy)methyl]-
| Molecular Formula | C14H7F5N2O5 |
|---|---|
| Molecular Weight | 378.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.02753 |
| Heavy Atoms | 26 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 87001-92-1 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OCC2=C(C(=C(C(=C2F)F)F)F)F)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | GSBGTPLZKSLHFN-UHFFFAOYSA-N |
Product Overview
Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- (CAS 87001-92-1), with molecular formula C14H7F5N2O5 and molecular weight 378.03 g/mol. IUPAC: 1,2,3,4,5-pentafluoro-6-[(2-methyl-4,6-dinitrophenoxy)methyl]benzene.
Chemical Property Profile of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-
Property Insights of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-
The XLogP value of 3.9 indicates that Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-. Following Lipinski's Rule of Five, Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- 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 Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-?
The CAS number of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- is 87001-92-1.
What is the molecular formula of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-?
The molecular formula of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- is C14H7F5N2O5.
What is the molecular weight of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-?
The molecular weight of Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- is 378.03 g/mol.
Where can I buy Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-?
You can request a quote for Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, pentafluoro((2-methyl-4,6-dinitrophenoxy)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.