733757-77-2
TERT-BUTYL 3-METHYL-6,7-DIHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE-5(4H)-CARBOXYLATE
NameTERT-BUTYL 3-METHYL-6,7-DIHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE-5(4H)-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 3-METHYL-6,7-DIHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE-5(4H)-CARBOXYLATE
【CAS】
【MDL】
MFCD11501665
【English Synonyms】
【Formula】
C12 H19 N3 O2
【MolWeight】
237.301
【Inchi】
InChI=1S/C12H19N3O2/c1-8-9-7-15(6-5-10(9)14-13-8)11(16)17-12(2,3)4/h5-7H2,1-4H3,(H,13,14)
【InChIKey】
InChIKey=SHUQCUCIHVYJSB-UHFFFAOYSA-N
【SMILES】
Cc1c2c([nH]n1)CCN(C2)C(=O)OC(C)(C)C
【MOL File】
TERT-BUTYL 3-METHYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 3-METHYL-6,7-DIHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINE-5(4H)-CARBOXYLATE.cml