79421-43-5
4-(4-HYDROXY-PIPERIDIN-1-YL)-BENZONITRILE
Name4-(4-HYDROXY-PIPERIDIN-1-YL)-BENZONITRILE
1Identification
【Name】
4-(4-HYDROXY-PIPERIDIN-1-YL)-BENZONITRILE
【CAS】
【MDL】
MFCD06656917
【English Synonyms】
【Formula】
C12 H14 N2 O
【MolWeight】
202.256
【Inchi】
InChI=1S/C12H14N2O/c13-9-10-1-3-11(4-2-10)14-7-5-12(15)6-8-14/h1-4,12,15H,5-8H2
【InChIKey】
InChIKey=AIFMEOHBBANOOK-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C#N)N2CCC(CC2)O
【MOL File】
4-(4-HYDROXY-PIPERID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(4-HYDROXY-PIPERIDIN-1-YL)-BENZONITRILE.cml