chempirical

6-Chloro-1-tetralone

C10H9ClOCAS 26673-31-4180.63 g/mol

Open in Covalent MOL file
OCl
Aryl halideKetone

Properties

Molecular formula
C10H9ClO
Molar mass
180.63 g/mol
Exact mass
180.0342 Da
Melting point
53 °C
Boiling point
167–169 °C (at 18 Torr)
logP
2.86Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
26673-31-4
SMILES
O=C1CCCc2cc(Cl)ccc21
InChIKey
WQKHERPPDYPMNX-UHFFFAOYSA-N
InChI
InChI=1S/C10H9ClO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3H2

Weigh it out

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

Names and synonyms

5 names
  • 1(2H)-Naphthalenone, 6-chloro-3,4-dihydro-
  • 6-Chloro-3,4-dihydro-1(2H)-naphthalenone
  • 6-Chloro-α-tetralone
  • 6-Chloro-3,4-dihydro-2H-naphthalen-1-one
  • 6-Chloro-1,2,3,4-tetrahydronaphthalen-1-one

Work with 6-Chloro-1-tetralone

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-1-indanone42348-86-781 % similar 3,4-Dihydro-6-hydroxy-1(2H)-naphthalenone3470-50-661 % similar 1-(2,4-Dichlorophenyl)-1-pentanone61023-66-359 % similar 6-Methoxy-1-tetralone1078-19-956 % similar 1-(2,4-Dichlorophenyl)-1-butanone66353-47-754 % similar Benzosuberone826-73-350 % similar 7-Methyl-1-tetralone22009-37-649 % similar 3,4-Dihydro-7-hydroxy-1(2H)-naphthalenone22009-38-749 % similar

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

Same formula

7-Chloro-3,4-dihydro-1(2H)-naphthalenone26673-32-5 4-(4-Chlorophenyl)-3-buten-2-one3160-40-5 (4-Chlorophenyl)cyclopropylmethanone6640-25-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook