31768-00-0
4-METHOXY-ALPHA,ALPHA-DIMETHYL-BETA-[(PHENYLMETHYL)AMINO]-BENZENEBUTANOIC ACID METHYL ESTER
Name4-METHOXY-ALPHA,ALPHA-DIMETHYL-BETA-[(PHENYLMETHYL)AMINO]-BENZENEBUTANOIC ACID METHYL ESTER
1Identification
【Name】
4-METHOXY-ALPHA,ALPHA-DIMETHYL-BETA-[(PHENYLMETHYL)AMINO]-BENZENEBUTANOIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD17015476
【English Synonyms】
【Formula】
C21 H27 N O3
【MolWeight】
341.448
【Inchi】
InChI=1S/C21H27NO3/c1-21(2,20(23)25-4)19(22-15-16-11-7-5-8-12-16)18(24-3)17-13-9-6-10-14-17/h5-14,18-19,22H,15H2,1-4H3
【InChIKey】
InChIKey=SWXKEMNKPKVUSK-UHFFFAOYSA-N
【SMILES】
CC(C)(C(C(c1ccccc1)OC)NCc2ccccc2)C(=O)OC
【MOL File】
4-METHOXY-ALPHA,ALPH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-METHOXY-ALPHA,ALPHA-DIMETHYL-BETA-[(PHENYLMETHYL)AMINO]-BENZENEBUTANOIC ACID METHYL ESTER.cml