857814-57-4
Benzenepropanoic acid, α-(aminomethyl)-4-(dimethylamino)-
NameBenzenepropanoic acid, α-(aminomethyl)-4-(dimethylamino)-
1Identification
【Name】
Benzenepropanoic acid, α-(aminomethyl)-4-(dimethylamino)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C12H18N2O2
【MolWeight】
222.2835
【Inchi】
InChI=1S/C12H18N2O2/c1-14(2)11-5-3-9(4-6-11)7-10(8-13)12(15)16/h3-6,10H,7-8,13H2,1-2H3,(H,15,16)
【InChIKey】
InChIKey=UBHBWFINVWXKBO-UHFFFAOYSA-N
【SMILES】
NCC(C(=O)O)CC1=CC=C(C=C1)N(C)C
【MOL File】
Benzenepropanoic aci….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Benzenepropanoic acid, α-(aminomethyl)-4-(dimethylamino)-.cml