5,7-Dimethyl-2,3-dihydro-1H-indole-2,3-dione

C₁₀H₉NO₂CAS 39603-24-2175.19 g/mol

Open in Covalent MOL file

Amide Ketone Lactam

Properties

Molecular formula: C₁₀H₉NO₂
Molar mass: 175.19 g/mol
Exact mass: 175.0633 Da
Melting point: 242 °C
logP: 1.44Crippen estimate
Polar surface area: 46.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H412 Harmful to aquatic life with long lasting effects100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number

39603-24-2

SMILES

Cc1cc(C)c2c(c1)C(=O)C(=O)N2

InChIKey

HFZSCCJTJGWTDZ-UHFFFAOYSA-N

InChI

InChI=1S/C10H9NO2/c1-5-3-6(2)8-7(4-5)9(12)10(13)11-8/h3-4H,1-2H3,(H,11,12,13)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names

5,7-Dimethylisatin
1H-Indole-2,3-dione, 5,7-dimethyl-
Isatin, 5,7-dimethyl-
5,7-Dimethyl-1H-indole-2,3-dione
5,7-Dimethylindoline-2,3-dione
5,7-Dimethyl-2,3-dihydro-2,3-dioxoindole

Work with 5,7-Dimethyl-2,3-dihydro-1H-indole-2,3-dione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Chloro-7-methylisatin14389-06-167 % similar 7-Methylisatin1127-59-958 % similar 5-Methylisatin608-05-954 % similar N,N'-Bis(4-hydroxy-2,6-dimethylphenyl)ethanediamide1809288-95-650 % similar 5,7-Dichloroisatin6374-92-145 % similar 7-Chloroisatin7477-63-645 % similar N-(2,4,6-Trimethylphenyl)thiourea91059-97-145 % similar 4-Bromo-7-methylisatin874375-17-443 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl indole-5-carboxylate1011-65-0 5-Methylindole-2-carboxylic acid10241-97-1 Methyl 4-cyano-2-methylbenzoate103261-67-2 5-Methoxyindole-3-carbaldehyde10601-19-1 Methyl 1H-indole-2-carboxylate1202-04-6 1-Methyl-1H-indole-2-carboxylic acid16136-58-6 2,3,4,5-Tetrahydro-1H-1-benzazepine-2,5-dione16511-38-9 4-Hydroxy-1-methyl-2(1H)-quinolinone1677-46-9

Elsewhere

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