1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone
TL;DR: 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone (CAS 688034-76-6) is a chemical compound with molecular formula C12H8F3NO2 and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-acetylindol-3-yl)-2,2,2-trifluoroethanone
Also Known As: 1-(1-acetylindol-3-yl)-2,2,2-trifluoroethanone, 1-acetyl-3-(2,2,2-trifluoroacetyl)indole, 1-(1-acetyl-1H-indol-3-yl)-2,2,2-trifluoroethanone
| Molecular Formula | C12H8F3NO2 |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 3.0464 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.05072 |
| Heavy Atoms | 18 |
| Complexity | 640.30023 |
Chemical Identifiers
| CAS Number | 688034-76-6 |
|---|---|
| SMILES | CC(=O)N1C=C(C2=CC=CC=C21)C(=O)C(F)(F)F |
Product Overview
1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone (CAS 688034-76-6), with molecular formula C12H8F3NO2 and molecular weight 255.05 g/mol. IUPAC: 1-(1-acetylindol-3-yl)-2,2,2-trifluoroethanone.
Chemical Property Profile of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone
Property Insights of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone
The XLogP value of 3.0464 indicates that 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.07 Ų, 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone has 0 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-Acetylindol-3-yl)-2,2,2-trifluoroethanone?
The CAS number of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone is 688034-76-6.
What is the molecular formula of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone?
The molecular formula of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone is C12H8F3NO2.
What is the molecular weight of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone?
The molecular weight of 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone is 255.05 g/mol.
Where can I buy 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone?
You can request a quote for 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Acetylindol-3-yl)-2,2,2-trifluoroethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.