94856-12-9
1-(4-TERT-BUTYLPHENYL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE
Name1-(4-TERT-BUTYLPHENYL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE
1Identification
【Name】
1-(4-TERT-BUTYLPHENYL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE
【CAS】
【MDL】
MFCD03421399
【English Synonyms】
【Formula】
C14 H15 F3 O2
【MolWeight】
272.264
【Inchi】
InChI=1S/C14H15F3O2/c1-13(2,3)10-6-4-9(5-7-10)11(18)8-12(19)14(15,16)17/h4-7H,8H2,1-3H3
【InChIKey】
InChIKey=UROAUAWOKMUVMK-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1ccc(cc1)C(=O)CC(=O)C(F)(F)F
【MOL File】
1-(4-TERT-BUTYLPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-TERT-BUTYLPHENYL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE.cml