52073-09-3
(6-ISOPROPYL-2-METHOXYCARBONYL-3-METHYLPHENOXY)ACETIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER
Name(6-ISOPROPYL-2-METHOXYCARBONYL-3-METHYLPHENOXY)ACETIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER
1Identification
【Name】
(6-ISOPROPYL-2-METHOXYCARBONYL-3-METHYLPHENOXY)ACETIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER
【CAS】
【MDL】
MFCD01672498
【English Synonyms】
【Formula】
C18 H27 N O5
【MolWeight】
337.413
【Inchi】
InChI=1S/C18H27NO5/c1-12(2)14-8-7-13(3)16(18(21)22-6)17(14)24-11-15(20)23-10-9-19(4)5/h7-8,12H,9-11H2,1-6H3
【InChIKey】
InChIKey=IBHICZHJJGSIKX-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1C(=O)OC)OCC(=O)OCCN(C)C)C(C)C
【MOL File】
(6-ISOPROPYL-2-METHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(6-ISOPROPYL-2-METHOXYCARBONYL-3-METHYLPHENOXY)ACETIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER.cml