939986-84-2
4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-[1,2']BIPYRIDINYL-4'-CARBONITRILE
Name4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-[1,2']BIPYRIDINYL-4'-CARBONITRILE
1Identification
【Name】
4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-[1,2']BIPYRIDINYL-4'-CARBONITRILE
【CAS】
【MDL】
MFCD09607851
【English Synonyms】
【Formula】
C11 H13 N3 O
【MolWeight】
203.244
【Inchi】
InChI=1S/C11H13N3O/c12-8-9-1-4-13-11(7-9)14-5-2-10(15)3-6-14/h1,4,7,10,15H,2-3,5-6H2
【InChIKey】
InChIKey=BAUHNANVWDYGQN-UHFFFAOYSA-N
【SMILES】
c1cnc(cc1C#N)N2CCC(CC2)O
【MOL File】
4-HYDROXY-3,4,5,6-TE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-[1,2']BIPYRIDINYL-4'-CARBONITRILE.cml