55823-02-4
1-(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)-3-(3-METHYLPHENYL)-3-BUTEN-2-ONE
Name1-(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)-3-(3-METHYLPHENYL)-3-BUTEN-2-ONE
1Identification
【Name】
1-(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)-3-(3-METHYLPHENYL)-3-BUTEN-2-ONE
【CAS】
【MDL】
MFCD18972881
【English Synonyms】
【Formula】
C23 H28 O
【MolWeight】
320.473
【Inchi】
InChI=1S/C23H28O/c1-15-9-8-10-19(11-15)18(4)22(24)14-21-16(2)12-20(13-17(21)3)23(5,6)7/h8-13H,4,14H2,1-3,5-7H3
【InChIKey】
InChIKey=SZJWDCVHMTUZEE-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)C(=C)C(=O)Cc2c(cc(cc2C)C(C)(C)C)C
【MOL File】
1-(4-TERT-BUTYL-2,6-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-TERT-BUTYL-2,6-DIMETHYLPHENYL)-3-(3-METHYLPHENYL)-3-BUTEN-2-ONE.cml