chempirical

4-Chloroindan-1-one

C9H7ClOCAS 15115-59-0166.60 g/mol

Open in Covalent MOL file
OCl
HalogenKetone

Properties

Molecular formula
C9H7ClO
Molar mass
166.60 g/mol
Exact mass
166.0185 Da
Melting point
89–90 °C
logP
2.47Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
15115-59-0
SMILES
O=C1CCc2c(Cl)cccc21
InChIKey
MYCZDIIPHIGLCH-UHFFFAOYSA-N
InChI
InChI=1S/C9H7ClO/c10-8-3-1-2-7-6(8)4-5-9(7)11/h1-3H,4-5H2

Weigh it out

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

Names and synonyms

4 names
  • 1H-Inden-1-one, 4-chloro-2,3-dihydro-
  • 1-Indanone, 4-chloro-
  • 4-Chloro-2,3-dihydro-1H-inden-1-one
  • 4-Chloroindanone

Work with 4-Chloroindan-1-one

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 7-Chloro-2,3-dihydro-1H-inden-1-one34911-25-6 5-Chloro-1-indanone42348-86-7 (2E)-3-(3-Chlorophenyl)-2-propenal56578-37-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook