184474-24-6
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 4-hydroxybutyl ester
NameBenzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 4-hydroxybutyl ester
1Identification
【Name】
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 4-hydroxybutyl ester
【CAS】
【MDL】
【English Synonyms】
【Formula】
C17H26O3
【MolWeight】
278.3865
【Inchi】
InChI=1S/C17H26O3/c1-13(2)12-15-6-8-16(9-7-15)14(3)17(19)20-11-5-4-10-18/h6-9,13-14,18H,4-5,10-12H2,1-3H3
【InChIKey】
InChIKey=LHOOMJCOKSYNPL-UHFFFAOYSA-N
【SMILES】
CC(C(=O)OCCCCO)C1=CC=C(C=C1)CC(C)C
【MOL File】
Benzeneacetic acid, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 4-hydroxybutyl ester.cml