5-Chloro-1-indanone

C₉H₇ClOCAS 42348-86-7166.60 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₇ClO
Molar mass: 166.60 g/mol
Exact mass: 166.0185 Da
Melting point: 96–97 °C
Boiling point: 150 °C (at 0.2 Torr)
logP: 2.47Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

42348-86-7

SMILES

O=C1CCc2cc(Cl)ccc21

InChIKey

MEDSHTHCZIOVPU-UHFFFAOYSA-N

InChI

InChI=1S/C9H7ClO/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5H,1,4H2

Weigh it out

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

Names and synonyms

4 names

1H-Inden-1-one, 5-chloro-2,3-dihydro-
1-Indanone, 5-chloro-
5-Chloro-2,3-dihydro-1H-inden-1-one
5-Chloro-2,3-dihydroinden-1-one

Work with 5-Chloro-1-indanone

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

Same formula

Cinnamoyl chloride102-92-1 4-Chloroindan-1-one15115-59-0 7-Chloro-2,3-dihydro-1H-inden-1-one34911-25-6 (2E)-3-(3-Chlorophenyl)-2-propenal56578-37-1

Elsewhere

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