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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9NO
Molecular Weight 159.1846
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ACETYLINDOLE

SMILES

CC(=O)C1=CNC2=C1C=CC=C2

InChI

InChIKey=VUIMBZIZZFSQEE-UHFFFAOYSA-N
InChI=1S/C10H9NO/c1-7(12)9-6-11-10-5-3-2-4-8(9)10/h2-6,11H,1H3

HIDE SMILES / InChI

Molecular Formula C10H9NO
Molecular Weight 159.1846
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Low-temperature study of 3-acetylindole at 110 K.
2008 Jul
Evaluation of indole-based probes for high-throughput screening of drug binding to human serum albumin: Analysis by high-performance affinity chromatography.
2009 Apr
Formyl- and acetylindols: vibrational spectroscopy of an expectably pharmacologically active compound family.
2009 Dec
Anti HIV-1 agents 5: synthesis and anti-HIV-1 activity of some N-arylsulfonyl-3-acetylindoles in vitro.
2010 Jun 15
Synthesis and antiviral activity of new indole-based heterocycles.
2010 Nov
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:33:02 GMT 2023
Edited
by admin
on Sat Dec 16 01:33:02 GMT 2023
Record UNII
0HAT270V6U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ACETYLINDOLE
Systematic Name English
NSC-47180
Code English
1-(1H-INDOL-3-YL)ETHANONE
Systematic Name English
3-INDOLYL METHYL KETONE
Systematic Name English
KETONE, INDOL-3-YL METHYL
Systematic Name English
3-ACETYL-1H-INDOLE
Systematic Name English
NSC-58084
Code English
ETHANONE, 1-(1H-INDOL-3-YL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10220570
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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NSC
58084
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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ECHA (EC/EINECS)
211-875-5
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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CAS
703-80-0
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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NSC
47180
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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FDA UNII
0HAT270V6U
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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MESH
C531932
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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PUBCHEM
12802
Created by admin on Sat Dec 16 01:33:02 GMT 2023 , Edited by admin on Sat Dec 16 01:33:02 GMT 2023
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