76631-46-4

Name 4-(2,3-DIMETHYL-BENZYL)-1H-IMIDAZOLE
CAS 76631-46-4
EINECS(EC#) 202-303-5
Molecular Formula C12H14N2
MDL Number MFCD00864351
Molecular Weight 186.25
MOL File 76631-46-4.mol
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Chemical Properties

Melting point  114-116°
Boiling point  386.5±11.0 °C(Predicted)
density  1.077±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 14.44±0.10(Predicted)
color  White to Off-White
InChI InChI=1S/C12H14N2/c1-9-4-3-5-11(10(9)2)6-12-7-13-8-14-12/h3-5,7-8H,6H2,1-2H3,(H,13,14)
InChIKey RHDJRPPFURBGLQ-UHFFFAOYSA-N
SMILES C1NC(CC2=CC=CC(C)=C2C)=CN=1

Safety Data

Toxicity
LD50 i.v. in mice: 35 mg/kg (Karjalayne, Kurkela)

Hazard Information

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