CAS 217487-17-7

1,1-bis[(~2~H_3_)methyl]-3-[4-(1-methylethyl)phenyl]urea

Description:

1,1-bis[(~2~H_3_)methyl]-3-[4-(1-methylethyl)phenyl]urea, with the CAS number 217487-17-7, is a synthetic organic compound characterized by its urea functional group, which is central to its structure. This compound features two deuterated methyl groups, indicating the presence of heavy hydrogen isotopes, which can influence its physical and chemical properties, such as stability and reactivity. The presence of a 4-(1-methylethyl)phenyl group suggests that it has a bulky aromatic substituent, which may affect its solubility and interaction with biological systems. Typically, compounds of this nature are studied for their potential applications in pharmaceuticals or agrochemicals, where the urea moiety can play a crucial role in biological activity. The specific isotopic labeling can also be useful in tracing studies or in understanding metabolic pathways. Overall, the compound's unique structure and isotopic composition make it a subject of interest in both synthetic chemistry and applied research.

Formula: C₁₂H₁₂D₆N₂O

InChI: InChI=1/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)/i3D3,4D3

InChI key: PUIYMUZLKQOUOZ-LIJFRPJRSA-N

SMILES: CC(C)c1ccc(cc1)NC(=O)N(C([2H])([2H])[2H])C([2H])([2H])[2H]

Isoproturon-d6

Controlled Product

CAS: 217487-17-7

Applications Isoproturon-d6 is deuterized or labeled form of Isoproturon (I874500), which is a pre-and post emergence herbicide for control of annual grasses and broad-leaved weeds. Herbicide.
References Fournier, J.-C., et al.: Chemosphere, 4, 207 (1975), Gonzales, P., et al.: Weed Res., 23, 39 (1983)

Formula: C₁₂H₁₂D₆N₂O

Color and Shape: Neat

Molecular weight: 212.32

Ref: TR-I874504

Isoproturon-D6

CAS: 1007461-76-8, 217487-17-7

Formula: C₁₂H₁₈N₂O

Molecular weight: 212.32

Ref: BE-BePure-23662