898777-43-0
4'-AZETIDINOMETHYL-2-CYANOBENZOPHENONE
Name4'-AZETIDINOMETHYL-2-CYANOBENZOPHENONE
1Identification
【Name】
4'-AZETIDINOMETHYL-2-CYANOBENZOPHENONE
【CAS】
【MDL】
MFCD03841559
【English Synonyms】
【Formula】
C18 H16 N2 O
【MolWeight】
276.337
【Inchi】
InChI=1S/C18H16N2O/c19-12-16-4-1-2-5-17(16)18(21)15-8-6-14(7-9-15)13-20-10-3-11-20/h1-2,4-9H,3,10-11,13H2
【InChIKey】
InChIKey=QUBHTRGESNNQRC-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C#N)C(=O)c2ccc(cc2)CN3CCC3
【MOL File】
4'-AZETIDINOMETHYL-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4'-AZETIDINOMETHYL-2-CYANOBENZOPHENONE.cml