| Identification | Back Directory | [Name]
1,3-diisopropyl-2-isothiocyanato-5-phenoxybenzene | [CAS]
80058-93-1 | [Synonyms]
DIPPI
4-phenoxy-2，6-diisopropyl phenyl isothiocyanate
1,3-diisopropyl-2-isothiocyanato-5-phenoxybenzene
2-Isothiocyanato-1,3-bis(1-methylethyl)-5-phenoxybenzene
Benzene, 2-isothiocyanato-1,3-bis(1-methylethyl)-5-phenoxy- | [Molecular Formula]
C19H21NOS | [MDL Number]
MFCD20526552 | [MOL File]
80058-93-1.mol | [Molecular Weight]
311.44 |
| Chemical Properties | Back Directory | [Boiling point ]
411.0±45.0 °C(Predicted) | [density ]
1.04±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C Freezer, Under inert atmosphere | [solubility ]
Dichloromethane; Ethyl Acetate; Methanol | [form ]
Solid | [color ]
Light Yellow | [InChI]
InChI=1S/C19H21NOS/c1-13(2)17-10-16(21-15-8-6-5-7-9-15)11-18(14(3)4)19(17)20-12-22/h5-11,13-14H,1-4H3 | [InChIKey]
ZZNJNNXQRSAGSP-UHFFFAOYSA-N | [SMILES]
C1(C(C)C)=CC(OC2=CC=CC=C2)=CC(C(C)C)=C1N=C=S |
| Hazard Information | Back Directory | [Chemical Properties]
This product is a light yellow oily viscous liquid, bp130～140℃/5Pa, decomposes in water, and is soluble in solvents such as xylene and trimethylbenzene. | [Uses]
2-Isothiocyanato-1,3-bis(1-methylethyl)-5-phenoxybenzene is a proposed intermediate in the synthesis of 6-Amino-1-(2,6-diisopropyl-4-phenoxyphenyl)-4-((2,6-diisopropyl-4-phenoxyphenyl)amino)-1,3,5-triazine-2(1H)-thione (A607450) is an impurity compound of Diafenthiuron (D310550), an insecticide. |
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