1H-Inden-2(3H)-one oxime

C₉H₉NOCAS 3349-63-1147.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₉NO
Molar mass: 147.18 g/mol
Exact mass: 147.0684 Da
Melting point: 153–154 °C
logP: 1.62Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

3349-63-1

SMILES

ON=C1Cc2ccccc2C1

InChIKey

UJLFLOAXKVGYIA-UHFFFAOYSA-N

InChI

InChI=1S/C9H9NO/c11-10-9-5-7-3-1-2-4-8(7)6-9/h1-4,11H,5-6H2

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

Names and synonyms

4 names

2-Indanone, oxime
2H-Inden-2-one, 1,3-dihydro-, oxime
NSC 54456
NSC 62556

Work with 1H-Inden-2(3H)-one oxime

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

2,3-Dihydro-1H-inden-1-one oxime3349-60-847 % similar 1-Tetralone oxime3349-64-244 % similar Benzyl phenyl ketoxime952-06-743 % similar 1,2-Benzenediacetic acid7500-53-043 % similar 2-Indanone615-13-442 % similar Oxindole59-48-341 % similar Diphenylglyoxime23873-81-641 % similar Fluorenone oxime2157-52-038 % similar

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

Same formula

5-Methoxyindole1006-94-6 (4-Methoxyphenyl)acetonitrile104-47-2 Indole-4-methanol1074-85-7 1H-Indole-7-methanol1074-87-9 Indole-5-methanol1075-25-8 6-Hydroxymethylindole1075-26-9 3,4-Dihydroisoquinolin-1(2H)-one1196-38-9 2-Methyl-1H-indol-5-ol13314-85-7

Elsewhere

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