864376-55-6
4-METHYL-4-(1-METHYLETHYL)-2-(4-METHYLPHENYL)-5(4H)-OXAZOLONE
Name4-METHYL-4-(1-METHYLETHYL)-2-(4-METHYLPHENYL)-5(4H)-OXAZOLONE
1Identification
【Name】
4-METHYL-4-(1-METHYLETHYL)-2-(4-METHYLPHENYL)-5(4H)-OXAZOLONE
【CAS】
【MDL】
MFCD16878561
【English Synonyms】
【Formula】
C14 H17 N O2
【MolWeight】
231.293
【Inchi】
InChI=1S/C14H17NO2/c1-9(2)14(4)13(16)17-12(15-14)11-7-5-10(3)6-8-11/h5-9H,1-4H3
【InChIKey】
InChIKey=VTYOTCDLCQXOFJ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)C2=NC(C(=O)O2)(C)C(C)C
【MOL File】
4-METHYL-4-(1-METHYL….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-METHYL-4-(1-METHYLETHYL)-2-(4-METHYLPHENYL)-5(4H)-OXAZOLONE.cml