86615-41-0
(R*,R*)-(+/-)-METHYL-4-(2-(2-HYDROXY-2-(3-CHLOROPHENYL)ETHYLAMINO)PROPYL)-PHENOXYACETATE, HBR
Name(R*,R*)-(+/-)-METHYL-4-(2-(2-HYDROXY-2-(3-CHLOROPHENYL)ETHYLAMINO)PROPYL)-PHENOXYACETATE, HBR
pro_formulaC20 H24 Cl N O4 . Br H
1Identification
【Name】
(R*,R*)-(+/-)-METHYL-4-(2-(2-HYDROXY-2-(3-CHLOROPHENYL)ETHYLAMINO)PROPYL)-PHENOXYACETATE, HBR
【CAS】
【MDL】
MFCD00889198
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C20 H24 Cl N O4 . Br H
【pro_molWeight】
458.777
【Inchi】
InChI=1S/C20H24ClNO4.BrH/c1-14(22-12-19(23)16-4-3-5-17(21)11-16)10-15-6-8-18(9-7-15)26-13-20(24)25-2;/h3-9,11,14,19,22-23H,10,12-13H2,1-2H3;1H
【InChIKey】
InChIKey=LPDGLMPJFGGZGN-UHFFFAOYSA-N
【SMILES】
CC(Cc1ccc(cc1)OCC(=O)OC)NCC(c2cccc(c2)Cl)O.Br
【MOL File】
(R*,R*)-(+/-)-METHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(R*,R*)-(+/-)-METHYL-4-(2-(2-HYDROXY-2-(3-CHLOROPHENYL)ETHYLAMINO)PROPYL)-PHENOXYACETATE, HBR.cml