1H-Indole-2,3-dione, 1-acetyl-5-methyl-

HCID 539947

Notes Reactions

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Basic information

CAS: 118726-65-1
Standard SMILES: CC(=O)N1C(=O)C(=O)c2cc(C)ccc21
InChIKey: WBZFMHWTHJMBGW-UHFFFAOYSA-N
Molecular formula: C11H9NO3
Average molar mass: 203.19 g/mol
Monoisotopic mass: 203.05824315

Names & identifiers

Preferred name: 1H-Indole-2,3-dione, 1-acetyl-5-methyl-
IUPAC: 1-acetyl-5-methylindole-2,3-dione

Names & synonyms

118726-65-11H-Indole-2,3-dione, 1-acetyl-5-methyl-DTXSID80337205RefChem:238908DTXCID30288293WBZFMHWTHJMBGW-UHFFFAOYSA-N1-Acetyl-5-methylindoline-2,3-dione1-acetyl-5-methylisatin1-Acetyl-5-methyl-1H-indole-2,3-dione1-Acetyl-5-methyl-2,3-dihydro-1H-indole-2,3-dione1-acetyl-5-methylindole-2,3-dioneCambridge id 6586072

Show more names

SCHEMBL7425627MFCD03137829STL573581AKOS0016406271-Acetyl-5-methyl-1H-indole-2,3-dione #SR-01000490972SR-01000490972-1

Database identifiers

CAS: 118726-65-1
PubChem CID: 539947
DTXSID: DTXSID80337205
Nikkaji: J2.579.450H

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 54.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 15
Formal charge: 0
Complexity: 337

Related reactions

2 records

New reaction record

HRID 6359As productuspto-grants-1993_09

HRID 935550As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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