864376-61-4
4-(1,1-DIMETHYLETHYL)-4-METHYL-2-PHENYL-5(4H)-OXAZOLONE
Name4-(1,1-DIMETHYLETHYL)-4-METHYL-2-PHENYL-5(4H)-OXAZOLONE
1Identification
【Name】
4-(1,1-DIMETHYLETHYL)-4-METHYL-2-PHENYL-5(4H)-OXAZOLONE
【CAS】
【MDL】
MFCD16878565
【English Synonyms】
【Formula】
C14 H17 N O2
【MolWeight】
231.293
【Inchi】
InChI=1S/C14H17NO2/c1-13(2,3)14(4)12(16)17-11(15-14)10-8-6-5-7-9-10/h5-9H,1-4H3
【InChIKey】
InChIKey=SGTJRTZEMHPSTC-UHFFFAOYSA-N
【SMILES】
CC1(C(=O)OC(=N1)c2ccccc2)C(C)(C)C
【MOL File】
4-(1,1-DIMETHYLETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(1,1-DIMETHYLETHYL)-4-METHYL-2-PHENYL-5(4H)-OXAZOLONE.cml