1161787-67-2
TRANS-METHYL 1-BENZYL-4-(2-METHYLPHENYL)PYRROLIDINE-3-CARBOXYLATE
NameTRANS-METHYL 1-BENZYL-4-(2-METHYLPHENYL)PYRROLIDINE-3-CARBOXYLATE
1Identification
【Name】
TRANS-METHYL 1-BENZYL-4-(2-METHYLPHENYL)PYRROLIDINE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD13195098
【English Synonyms】
【Formula】
C20 H23 N O2
【MolWeight】
309.407
【Inchi】
InChI=1S/C20H23NO2/c1-15-8-6-7-11-17(15)18-13-21(14-19(18)20(22)23-2)12-16-9-4-3-5-10-16/h3-11,18-19H,12-14H2,1-2H3/t18-,19+/m1/s1
【InChIKey】
InChIKey=AKLVRPZDSXFZDN-MOPGFXCFSA-N
【SMILES】
Cc1ccccc1[C@H]2CN(C[C@@H]2C(=O)OC)Cc3ccccc3
【MOL File】
TRANS-METHYL 1-BENZY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
TRANS-METHYL 1-BENZYL-4-(2-METHYLPHENYL)PYRROLIDINE-3-CARBOXYLATE.cml