CAS Registry Number 55809-53-5
Name:
Isoxazole, 5-​(1,​1-​dimethylethyl)​-​3-​isocyanato-
5-tert-Butyl-3-isocyanatoisoxazole
5-tert-Butyl-3-isoxazolyl isocyanate

Chemical Formula: C8H10N2O2
Exact Mass: 166.07
Molecular Weight: 166.18
m/z: 166.07 (100.0%), 167.08 (8.8%)

InChI: InChI=1S/C8H10N2O2/c1-8(2,3)6-4-7(9-5-11)10-12-6/h4H,1-3H3
InChIKey: IQMVRIMSTBTDLV-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)C1=CC(=NO1)N=C=O

Specification

98%

PCT Int. Appl. (2014), WO 2014015673 A1 20140130.

PCT Int. Appl. (2013), WO 2013091502 A1 20130627.