37765-76-7
PROPANEDIOIC ACID, 2-[[4-(1,1-DIMETHYLETHYL)PHENYL]METHYL]-, 1,3-DIETHYL ESTER
NamePROPANEDIOIC ACID, 2-[[4-(1,1-DIMETHYLETHYL)PHENYL]METHYL]-, 1,3-DIETHYL ESTER
1Identification
【Name】
PROPANEDIOIC ACID, 2-[[4-(1,1-DIMETHYLETHYL)PHENYL]METHYL]-, 1,3-DIETHYL ESTER
【CAS】
【MDL】
MFCD17015524
【English Synonyms】
【Formula】
C18 H26 O4
【MolWeight】
306.399
【Inchi】
InChI=1S/C18H26O4/c1-6-21-16(19)15(17(20)22-7-2)12-13-8-10-14(11-9-13)18(3,4)5/h8-11,15H,6-7,12H2,1-5H3
【InChIKey】
InChIKey=CJZSLGCAXITSKS-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(Cc1ccc(cc1)C(C)(C)C)C(=O)OCC
【MOL File】
PROPANEDIOIC ACID, 2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PROPANEDIOIC ACID, 2-[[4-(1,1-DIMETHYLETHYL)PHENYL]METHYL]-, 1,3-DIETHYL ESTER.cml