3-(2-Chloro-4-Isocyanato-Phenyl)-5-Tert-Butyl-1,3,4-Oxadiazol-2-One
[CAS# 97659-35-3]

Identification

• Name: 3-(2-Chloro-4-Isocyanato-Phenyl)-5-Tert-Butyl-1,3,4-Oxadiazol-2-One
• Synonyms: 5-Tert-Butyl-3-(2-Chloro-4-Isocyanato-Phenyl)-1,3,4-Oxadiazol-2-One; 3-(2-Chloro-4-Isocyanatophenyl)-5-(1,1-Dimethylethyl)-1,3,4-Oxadiazol-2(3H)-One
• Molecular Formula: C₁₃H₁₂ClN₃O₃
• Molecular Weight: 293.71
• CAS Registry Number: 97659-35-3
• EINECS: 307-438-4
• SMILES: O=C=NC2=CC(=C(N1N=C(OC1=O)C(C)(C)C)C=C2)Cl
• InChI: 1S/C13H12ClN3O3/c1-13(2,3)11-16-17(12(19)20-11)10-5-4-8(15-7-18)6-9(10)14/h4-6H,1-3H3
• InChIKey: WSQMDTRLPZJJGY-UHFFFAOYSA-N