53206-77-2
(2-ETHOXYCARBONYL-6-ISOPROPYL-3-METHYLPHENOXY)ACETIC ACID 2-PIPERIDINOETHYL ESTER
Name(2-ETHOXYCARBONYL-6-ISOPROPYL-3-METHYLPHENOXY)ACETIC ACID 2-PIPERIDINOETHYL ESTER
1Identification
【Name】
(2-ETHOXYCARBONYL-6-ISOPROPYL-3-METHYLPHENOXY)ACETIC ACID 2-PIPERIDINOETHYL ESTER
【CAS】
【MDL】
MFCD01672361
【English Synonyms】
【Formula】
C22 H33 N O5
【MolWeight】
391.505
【Inchi】
InChI=1S/C22H33NO5/c1-5-26-22(25)20-17(4)9-10-18(16(2)3)21(20)28-15-19(24)27-14-13-23-11-7-6-8-12-23/h9-10,16H,5-8,11-15H2,1-4H3
【InChIKey】
InChIKey=AABQVBFXZKSBOW-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(ccc(c1OCC(=O)OCCN2CCCCC2)C(C)C)C
【MOL File】
(2-ETHOXYCARBONYL-6-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2-ETHOXYCARBONYL-6-ISOPROPYL-3-METHYLPHENOXY)ACETIC ACID 2-PIPERIDINOETHYL ESTER.cml