1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol
TL;DR: 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol (CAS 7594-49-2) is a chemical compound with molecular formula C4HCl3F6O and molecular weight 283.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trichloro-3,3,3-trifluoro-2-(trifluoromethyl)propan-2-ol
Also Known As: 1,1-Bis(trifluoromethyl)-2,2,2-trichloroethanol, starbld0018409, C4HCl3F6O, PALLADIUM(II)SULFATE, 1,1,1-trichloro-3,3,3-trifluoro-2-(trifluoromethyl)propan-2-ol
| Molecular Formula | C4HCl3F6O |
|---|---|
| Molecular Weight | 283.90 g/mol |
| LogP | 3.2123 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 283.89972 |
| Heavy Atoms | 14 |
| Complexity | 178.54808 |
Chemical Identifiers
| CAS Number | 7594-49-2 |
|---|---|
| SMILES | C(C(F)(F)F)(C(F)(F)F)(C(Cl)(Cl)Cl)O |
Product Overview
1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol (CAS 7594-49-2), with molecular formula C4HCl3F6O and molecular weight 283.90 g/mol. IUPAC: 1,1,1-trichloro-3,3,3-trifluoro-2-(trifluoromethyl)propan-2-ol.
Chemical Property Profile of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol
Property Insights of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol
The XLogP value of 3.2123 indicates that 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol has 1 hydrogen bond donor(s) and 1 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-(trichloromethyl)propan-2-ol?
The CAS number of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol is 7594-49-2.
What is the molecular formula of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol?
The molecular formula of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol is C4HCl3F6O.
What is the molecular weight of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol?
The molecular weight of 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol is 283.90 g/mol.
Where can I buy 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol?
You can request a quote for 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)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-(trichloromethyl)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,3,3,3-Hexafluoro-2-(trichloromethyl)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.