27463-38-3

Name 5-(4-CHLOROPHENYL)-1,3-CYCLOHEXANEDIONE
CAS 27463-38-3
Molecular Formula C12H11ClO2
MDL Number MFCD00052452
Molecular Weight 222.67
MOL File 27463-38-3.mol
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Chemical Properties

Melting point  185-189 °C(lit.)
Boiling point  384.217±42.00 °C(Press: 760.00 Torr)(predicted)
density  1.268±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka 4.840±0.20(predicted)
InChI 1S/C12H11ClO2/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-4,9H,5-7H2
InChIKey MAFYKXZPGMHTIA-UHFFFAOYSA-N
SMILES Clc1ccc(cc1)C2CC(=O)CC(=O)C2

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319-H335-H302+H312+H332-H315
Precautionary statements  P301+P312-P302+P352-P305+P351+P338
Safety Statements 
WGK Germany  3
HazardClass  IRRITANT
HS Code  2914790090
Storage Class 13 - Non Combustible Solids

Hazard Information

Spectrum Detail

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