99854-88-3

Name 5-tert-Butyl-1,3-benzoxazol-2(3H)-one
CAS 99854-88-3
Molecular Formula C11H13NO2
MDL Number MFCD08446987
Molecular Weight 191.23
MOL File 99854-88-3.mol

Chemical Properties

density  1.132±0.06 g/cm3(Predicted)
form  solid
pka 9.51±0.70(Predicted)
InChI 1S/C11H13NO2/c1-11(2,3)7-4-5-9-8(6-7)12-10(13)14-9/h4-6H,1-3H3,(H,12,13)
InChIKey CSKXTTYRNZFYNH-UHFFFAOYSA-N
SMILES CC(C)(C1=CC(N=C2O)=C(O2)C=C1)C

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1

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