57598-46-6
[1,1'-BIPHENYL]-2-CARBOXYLIC ACID, 4'-(DIMETHYLAMINO)-6-METHOXY-, HYDROCHLORIDE
Name[1,1'-BIPHENYL]-2-CARBOXYLIC ACID, 4'-(DIMETHYLAMINO)-6-METHOXY-, HYDROCHLORIDE
pro_formulaC16 H17 N O3 . Cl H
1Identification
【Name】
[1,1'-BIPHENYL]-2-CARBOXYLIC ACID, 4'-(DIMETHYLAMINO)-6-METHOXY-, HYDROCHLORIDE
【CAS】
【MDL】
MFCD17677218
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H17 N O3 . Cl H
【pro_molWeight】
307.775
【Inchi】
InChI=1S/C16H17NO3.ClH/c1-17(2)12-9-7-11(8-10-12)15-13(16(18)19)5-4-6-14(15)20-3;/h4-10H,1-3H3,(H,18,19);1H
【InChIKey】
InChIKey=CWEVVEXBQZDOCN-UHFFFAOYSA-N
【SMILES】
CN(C)c1ccc(cc1)c2c(cccc2OC)C(=O)O.Cl
【MOL File】
[1,1'-BIPHENYL]-2-CA….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
[1,1'-BIPHENYL]-2-CARBOXYLIC ACID, 4'-(DIMETHYLAMINO)-6-METHOXY-, HYDROCHLORIDE.cml