4-(2,3-Dimethyl-benzyl)-1H-imidazole

Chemical Properties

Melting point	114-116°
Boiling point	386.5±11.0 °C(Predicted)
Density	1.077±0.06 g/cm3(Predicted)
storage temp.	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	CC1=C(C=CC=C1C)CC2=CN=CN2
SMILES	C1NC(CC2=CC=CC(C)=C2C)=CN=1

Toxicity

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

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