3-(2-Chloro-4-isocyanatophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one
CAS Registry Number®
97659-35-3
CAS Name
3-(2-Chloro-4-isocyanatophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-oneMolecular Formula
C13H12ClN3O3Molecular Mass
293.71Cite this Page
3-(2-Chloro-4-isocyanatophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=97659-35-3 (retrieved ) (CAS RN: 97659-35-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
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
InChIKey=WSQMDTRLPZJJGY-UHFFFAOYSA-N
SMILES
O=C1N(N=C(C(C)(C)C)O1)C2=C(Cl)C=C(N=C=O)C=C2
Canonical SMILES
O=C=NC1=CC=C(C(Cl)=C1)N2N=C(OC2=O)C(C)(C)C
Other Names for this Substance
- 1,3,4-Oxadiazol-2(3H)-one, 3-(2-chloro-4-isocyanatophenyl)-5-(1,1-dimethylethyl)-
- 3-(2-Chloro-4-isocyanatophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one
