886363-92-4
1-[2-AMINO-1-(3-CHLORO-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLIC ACID
Name1-[2-AMINO-1-(3-CHLORO-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
1-[2-AMINO-1-(3-CHLORO-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD07369825
【English Synonyms】
【Formula】
C13 H17 Cl N2 O2
【MolWeight】
268.742
【Inchi】
InChI=1S/C13H17ClN2O2/c14-11-3-1-2-9(6-11)12(7-15)16-5-4-10(8-16)13(17)18/h1-3,6,10,12H,4-5,7-8,15H2,(H,17,18)
【InChIKey】
InChIKey=OFYQCQTXNGVHCI-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)Cl)C(CN)N2CCC(C2)C(=O)O
【MOL File】
1-[2-AMINO-1-(3-CHLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:-1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-[2-AMINO-1-(3-CHLORO-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLIC ACID.cml