RefChem:292997
TL;DR: RefChem:292997 (CAS 101913-85-3) is a chemical compound with molecular formula C18H12F24N2O4 and molecular weight 776.0414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1,7,7,7-hexafluoro-4-[[1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)heptan-4-ylidene]hydrazinylidene]-2,6-bis(trifluoromethyl)heptane-2,6-diol
Also Known As: NCI60_020866, 4-Heptanone, 2,6-bis(trifluoromethyl)-2,6-dihydroxy-1,1,1,7,7,7-hexafluoro-, azine, 1,1,1,7,7,7-Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-4-heptanone azine, 1,1,1,7,7,7-Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-4-heptanone (4,4,4-trifluoro-3-hydroxy-1-(3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl)-3-(trifluoromethyl)butylidene)hydrazone, 1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-4-heptanone(4,4,4-trifluoro-3-hydroxy-1-(3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl)-3-(trifluoromethyl)butylidene)hydrazone
Technical Specifications
| Molecular Formula | C18H12F24N2O4 |
| Molecular Weight | 776.0414 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 9 |
| Exact Mass | 776.0414 Da |
| Heavy Atoms | 48 |
| Complexity | 945.0 |
| SMILES | C(C(=NN=C(CC(C(F)(F)F)(C(F)(F)F)O)CC(C(F)(F)F)(C(F)(F)F)O)CC(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O |
| InChIKey | HDXYKTXHFBJCQB-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:292997
Property Insights of RefChem:292997
The XLogP value of 5.9 indicates that RefChem:292997 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:292997. Following Lipinski's Rule of Five, RefChem:292997 has 4 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:292997?
The CAS number of RefChem:292997 is 101913-85-3.
What is the molecular formula of RefChem:292997?
The molecular formula of RefChem:292997 is C18H12F24N2O4.
What is the molecular weight of RefChem:292997?
The molecular weight of RefChem:292997 is 776.0414 g/mol.
Where can I buy RefChem:292997?
You can request a quote for RefChem:292997 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:292997?
Yes, CoreyChem provides custom synthesis services for RefChem:292997 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.