2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-
TL;DR: 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- (CAS 100482-47-1) is a chemical compound with molecular formula C11H10F6O and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trifluoro-4-phenyl-2-(trifluoromethyl)butan-2-ol
Also Known As: 2-BUTANOL, 4-PHENYL-1,1,1-TRIFLUORO-2-TRIFLUOROMETHYL-, 4-Phenyl-1,1,1-trifluoro-2-trifluoromethyl-2-butanol, 1,1,1-trifluoro-4-phenyl-2-(trifluoromethyl)butan-2-ol, Benzenepropanol, .alpha.,.alpha.-bis(trifluoromethyl)-, 1,1,1-Trifluoro-2-(trifluoromethyl)-4-phenyl-2-butanol
| Molecular Formula | C11H10F6O |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0636 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 100482-47-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(C(F)(F)F)(C(F)(F)F)O |
| InChIKey | UPXUFKHOKCDHIX-UHFFFAOYSA-N |
Product Overview
2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- (CAS 100482-47-1), with molecular formula C11H10F6O and molecular weight 272.06 g/mol. IUPAC: 1,1,1-trifluoro-4-phenyl-2-(trifluoromethyl)butan-2-ol.
Chemical Property Profile of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-
Property Insights of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-
The XLogP value of 4.0 indicates that 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- has 1 hydrogen bond donor(s) and 7 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 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-?
The CAS number of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- is 100482-47-1.
What is the molecular formula of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-?
The molecular formula of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- is C11H10F6O.
What is the molecular weight of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-?
The molecular weight of 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- is 272.06 g/mol.
Where can I buy 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-?
You can request a quote for 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanol, 4-phenyl-1,1,1-trifluoro-2-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.