Identification Chemical Properties Hazard Information Supplier

2079878-75-2

Name 2-(2-Chlorophenyl)-2-nitrocyclohexanone
CAS 2079878-75-2
EINECS(EC#) 205-516-1
Molecular Formula C12H12ClNO3
Molecular Weight 253.68
MOL File 2079878-75-2.mol
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Chemical Properties

Boiling point  412.5±45.0 °C(Predicted)
density  1.33±0.1 g/cm3(Predicted)
solubility  DMF: 30 mg/ml
DMSO: 10 mg/ml
Ethanol: 0.5 mg/ml
InChI InChI=1S/C12H12ClNO3/c13-10-6-2-1-5-9(10)12(14(16)17)8-4-3-7-11(12)15/h1-2,5-6H,3-4,7-8H2
InChIKey OBRSWNBWMZPYHU-UHFFFAOYSA-N
SMILES C1(=O)CCCCC1(C1=CC=CC=C1Cl)[N+]([O-])=O

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