(S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone
TL;DR: (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone (CAS 116330-64-4) is a chemical compound with molecular formula C10H9F3O2 and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-4,4,4-trifluoro-3-hydroxy-1-phenylbutan-1-one
Also Known As: J1.652.203A, 4,4,4-trifluoro-3-hydroxy-1-phenyl-butan-1-one, (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone, (S)-1-Phenyl-3-hydroxy-4,4,4-trifluorobutane-1-one, Phenyl[(S)-2-hydroxy-3,3,3-trifluoropropyl] ketone
| Molecular Formula | C10H9F3O2 |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 2.1826 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.05547 |
| Heavy Atoms | 15 |
| Complexity | 332.27078 |
Chemical Identifiers
| CAS Number | 116330-64-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C[C@@H](C(F)(F)F)O |
Product Overview
(S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone (CAS 116330-64-4), with molecular formula C10H9F3O2 and molecular weight 218.06 g/mol. IUPAC: (3S)-4,4,4-trifluoro-3-hydroxy-1-phenylbutan-1-one.
Chemical Property Profile of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone
Property Insights of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone
The XLogP value of 2.1826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone. With a topological polar surface area (TPSA) of 37.3 Ų, (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone 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 (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone?
The CAS number of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone is 116330-64-4.
What is the molecular formula of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone?
The molecular formula of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone is C10H9F3O2.
What is the molecular weight of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone?
The molecular weight of (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone is 218.06 g/mol.
Where can I buy (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone?
You can request a quote for (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone?
Yes, KEHONG BIO provides custom synthesis services for (S)-beta-Hydroxy-gamma,gamma,gamma-trifluorobutyrophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.