929884-77-5
TERT-BUTYL 4-(4-CYANO-2-FLUOROPHENYL)PIPERAZINE-1-CARBOXYLATE
NameTERT-BUTYL 4-(4-CYANO-2-FLUOROPHENYL)PIPERAZINE-1-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 4-(4-CYANO-2-FLUOROPHENYL)PIPERAZINE-1-CARBOXYLATE
【CAS】
【MDL】
MFCD11041846
【English Synonyms】
【Formula】
C16 H20 F N3 O2
【MolWeight】
305.351
【Inchi】
InChI=1S/C16H20FN3O2/c1-16(2,3)22-15(21)20-8-6-19(7-9-20)14-5-4-12(11-18)10-13(14)17/h4-5,10H,6-9H2,1-3H3
【InChIKey】
InChIKey=OEKYOMNSNFVAET-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(cc2F)C#N
【MOL File】
TERT-BUTYL 4-(4-CYAN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 4-(4-CYANO-2-FLUOROPHENYL)PIPERAZINE-1-CARBOXYLATE.cml