1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol
TL;DR: 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol (CAS 723294-76-6) is a chemical compound with molecular formula C8H11F6NO and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trifluoro-4-propan-2-ylimino-2-(trifluoromethyl)butan-2-ol
Also Known As: 1,1,1-trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol, 1-iso-propylimino-4,4,4-trifluoro-3-trifluoromethylbutan-3-ol, 1,1,1-trifluoro-4-propan-2-ylimino-2-(trifluoromethyl)butan-2-ol, 1-isopropylimino-4,4,4-trifluoro-3-(trifluoromethyl)butan-3-ol, 1-ISOPROPYLIMINO-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYLBUTAN-3-OL
| Molecular Formula | C8H11F6NO |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 2.7114 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.07448 |
| Heavy Atoms | 16 |
| Complexity | 240.2346 |
Chemical Identifiers
| CAS Number | 723294-76-6 |
|---|---|
| SMILES | CC(C)N=CCC(C(F)(F)F)(C(F)(F)F)O |
Product Overview
1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol (CAS 723294-76-6), with molecular formula C8H11F6NO and molecular weight 251.07 g/mol. IUPAC: 1,1,1-trifluoro-4-propan-2-ylimino-2-(trifluoromethyl)butan-2-ol.
Chemical Property Profile of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol
Property Insights of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol
The XLogP value of 2.7114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol. With a topological polar surface area (TPSA) of 32.59 Ų, 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol has 1 hydrogen bond donor(s) and 2 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-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol?
The CAS number of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol is 723294-76-6.
What is the molecular formula of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol?
The molecular formula of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol is C8H11F6NO.
What is the molecular weight of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol?
The molecular weight of 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol is 251.07 g/mol.
Where can I buy 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol?
You can request a quote for 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-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-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1-Trifluoro-4-isopropylimino-2-(trifluoromethyl)butane-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.