319451-51-9
1-AZETIDINECARBOXYLIC ACID, 3-(4-NITROPHENOXY)-, 1,1-DIMETHYLETHYL ESTER
Name1-AZETIDINECARBOXYLIC ACID, 3-(4-NITROPHENOXY)-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
1-AZETIDINECARBOXYLIC ACID, 3-(4-NITROPHENOXY)-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD17215703
【English Synonyms】
【Formula】
C14 H18 N2 O5
【MolWeight】
294.305
【Inchi】
InChI=1S/C14H18N2O5/c1-14(2,3)21-13(17)15-8-12(9-15)20-11-6-4-10(5-7-11)16(18)19/h4-7,12H,8-9H2,1-3H3
【InChIKey】
InChIKey=NDUZQXBYBMSROL-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CC(C1)Oc2ccc(cc2)[N+](=O)[O-]
【MOL File】
1-AZETIDINECARBOXYLI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-AZETIDINECARBOXYLIC ACID, 3-(4-NITROPHENOXY)-, 1,1-DIMETHYLETHYL ESTER.cml