2597-09-3
2-ALLYL-2-PHENYL-4-PENTENOIC ACID 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE
Name2-ALLYL-2-PHENYL-4-PENTENOIC ACID 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE
pro_formulaC20 H29 N O2 . Cl H
1Identification
【Name】
2-ALLYL-2-PHENYL-4-PENTENOIC ACID 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE
【CAS】
【MDL】
MFCD01709130
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C20 H29 N O2 . Cl H
【pro_molWeight】
351.915
【Inchi】
InChI=1S/C20H29NO2.ClH/c1-5-14-20(15-6-2,18-12-10-9-11-13-18)19(22)23-17-16-21(7-3)8-4;/h5-6,9-13H,1-2,7-8,14-17H2,3-4H3;1H
【InChIKey】
InChIKey=MQGBQYAOOTZEQH-UHFFFAOYSA-N
【SMILES】
CCN(CC)CCOC(=O)C(CC=C)(CC=C)c1ccccc1.Cl
【MOL File】
2-ALLYL-2-PHENYL-4-P….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-ALLYL-2-PHENYL-4-PENTENOIC ACID 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE.cml