Synonym
3-Acetylindole; 3-Acetylindole; 3-Acetylindole; Acetyl-3-indole; 3-Acetyl-1H-indole;
IUPAC/Chemical Name
Ethanone, 1-(1H-indol-3-yl)- (9CI)
InChi Key
VUIMBZIZZFSQEE-UHFFFAOYSA-N
InChi Code
InChI=1S/C10H9NO/c1-7(12)9-6-11-10-5-3-2-4-8(9)10/h2-6,11H,1H3
SMILES Code
CC(C1=CNC2=C1C=CC=C2)=O
Purity
>97% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.03.00
Preparing Stock Solutions
The following data is based on the
product
molecular weight
159.19
Batch specific molecular weights may vary
from batch to batch
due to the degree of hydration, which will
affect the solvent
volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass |
1 mg |
5 mg |
10 mg |
| 1 mM |
1.15 mL |
5.76 mL |
11.51 mL |
| 5 mM |
0.23 mL |
1.15 mL |
2.3 mL |
| 10 mM |
0.12 mL |
0.58 mL |
1.15 mL |
| 50 mM |
0.02 mL |
0.12 mL |
0.23 mL |
1: Billes F, Podea PV, Mohammed-Ziegler I, Toşa M, Mikosch H, Irimie DF. Formyl- and acetylindols: vibrational spectroscopy of an expectably pharmacologically active compound family. Spectrochim Acta A Mol Biomol Spectrosc. 2009 Dec;74(5):1031-45. doi: 10.1016/j.saa.2009.08.044. Epub 2009 Aug 28. PubMed PMID: 19875329.
2: Ran JQ, Huang N, Xu H, Yang LM, Lv M, Zheng YT. Anti HIV-1 agents 5: synthesis and anti-HIV-1 activity of some N-arylsulfonyl-3-acetylindoles in vitro. Bioorg Med Chem Lett. 2010 Jun 15;20(12):3534-6. doi: 10.1016/j.bmcl.2010.04.132. Epub 2010 May 18. PubMed PMID: 20488700.
3: Abdel-Gawad H, Mohamed HA, Dawood KM, Badria FA. Synthesis and antiviral activity of new indole-based heterocycles. Chem Pharm Bull (Tokyo). 2010 Nov;58(11):1529-31. PubMed PMID: 21048349.
4: Shukla VK, Al-Abdullah ES, El-Emam AA, Sachan AK, Pathak SK, Kumar A, Prasad O, Bishnoi A, Sinha L. Spectroscopic (FT-IR, FT-Raman, and UV-visible) and quantum chemical studies on molecular geometry, Frontier molecular orbitals, NBO, NLO and thermodynamic properties of 1-acetylindole. Spectrochim Acta A Mol Biomol Spectrosc. 2014 Dec 10;133:626-38. doi: 10.1016/j.saa.2014.06.043. Epub 2014 Jun 14. PubMed PMID: 24996206.
5: Hachuła B, Pyzik A, Nowak M, Kusz J. Low-temperature study of 3-acetylindole at 110 K. Acta Crystallogr C. 2008 Jul;64(Pt 7):o398-401. doi: 10.1107/S0108270108017733. Epub 2008 Jun 21. PubMed PMID: 18599988.
6: Ban X, Pan Y, Lin Y, Wang S, Du Y, Zhao K. Synthesis of carbazolones and 3-acetylindoles via oxidative C-N bond formation through PIFA-mediated annulation of 2-aryl enaminones. Org Biomol Chem. 2012 May 14;10(18):3606-9. doi: 10.1039/c2ob25348h. Epub 2012 Apr 3. PubMed PMID: 22495470.
