1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol
TL;DR: 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol (CAS 88911-72-2) is a chemical compound with molecular formula C10H6F6N2O5 and molecular weight 348.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,3,3,3-hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol
Also Known As: 1,1,1,3,3,3-hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol, A2044/0085931
| Molecular Formula | C10H6F6N2O5 |
|---|---|
| Molecular Weight | 348.02 g/mol |
| LogP | 3.12362 |
| Topological Polar Surface Area | 106.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.0181 |
| Heavy Atoms | 23 |
| Complexity | 619.68097 |
Chemical Identifiers
| CAS Number | 88911-72-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])C(C(F)(F)F)(C(F)(F)F)O)[N+](=O)[O-] |
Product Overview
1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol (CAS 88911-72-2), with molecular formula C10H6F6N2O5 and molecular weight 348.02 g/mol. IUPAC: 1,1,1,3,3,3-hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol.
Chemical Property Profile of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol
Property Insights of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol
The XLogP value of 3.12362 indicates that 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol. Following Lipinski's Rule of Five, 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol has 1 hydrogen bond donor(s) and 5 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 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol?
The CAS number of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol is 88911-72-2.
What is the molecular formula of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol?
The molecular formula of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol is C10H6F6N2O5.
What is the molecular weight of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol?
The molecular weight of 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol is 348.02 g/mol.
Where can I buy 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol?
You can request a quote for 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,3,3,3-Hexafluoro-2-(4-methyl-3,5-dinitrophenyl)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.