2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-
TL;DR: 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- (CAS 101976-55-0) is a chemical compound with molecular formula C6H6Cl2F6O and molecular weight 277.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)pentan-2-ol
Also Known As: 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-, 4,4-Dichloro-1,1,1-trifluoro-2-trifluoromethyl-2-pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)pentan-2-ol, 2-Pentanol,4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-, 4,4-Dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-2-pentanol
| Molecular Formula | C6H6Cl2F6O |
|---|---|
| Molecular Weight | 277.97 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.97 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 101976-55-0 |
|---|---|
| SMILES | CC(CC(C(F)(F)F)(C(F)(F)F)O)(Cl)Cl |
| InChIKey | QLVOOYXXQZSRGC-UHFFFAOYSA-N |
Product Overview
2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- (CAS 101976-55-0), with molecular formula C6H6Cl2F6O and molecular weight 277.97 g/mol. IUPAC: 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)pentan-2-ol.
Chemical Property Profile of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-
Property Insights of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-
The XLogP value of 3.5 indicates that 2-Pentanol, 4,4-dichloro-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-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentanol, 4,4-dichloro-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-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-?
The CAS number of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- is 101976-55-0.
What is the molecular formula of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-?
The molecular formula of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- is C6H6Cl2F6O.
What is the molecular weight of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-?
The molecular weight of 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- is 277.97 g/mol.
Where can I buy 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-?
You can request a quote for 2-Pentanol, 4,4-dichloro-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-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentanol, 4,4-dichloro-1,1,1-trifluoro-2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.