939986-60-4
3-(5-NITRO-PYRIDIN-2-YLOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Name3-(5-NITRO-PYRIDIN-2-YLOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1Identification
【Name】
3-(5-NITRO-PYRIDIN-2-YLOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD09607621
【English Synonyms】
【Formula】
C15 H21 N3 O5
【MolWeight】
323.347
【Inchi】
InChI=1S/C15H21N3O5/c1-15(2,3)23-14(19)17-8-4-5-12(10-17)22-13-7-6-11(9-16-13)18(20)21/h6-7,9,12H,4-5,8,10H2,1-3H3
【InChIKey】
InChIKey=IJLKUIAADAPLFZ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCCC(C1)Oc2ccc(cn2)[N+](=O)[O-]
【MOL File】
3-(5-NITRO-PYRIDIN-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(5-NITRO-PYRIDIN-2-YLOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER.cml