132813-14-0
2-CHLORO-4-(4-FLUOROPHENYL)-5,6,7,8,9,10-HEXAHYDROCYCLOOCTA[B]PYRIDINE
Name2-CHLORO-4-(4-FLUOROPHENYL)-5,6,7,8,9,10-HEXAHYDROCYCLOOCTA[B]PYRIDINE
1Identification
【Name】
2-CHLORO-4-(4-FLUOROPHENYL)-5,6,7,8,9,10-HEXAHYDROCYCLOOCTA[B]PYRIDINE
【CAS】
【MDL】
MFCD09955376
【English Synonyms】
【Formula】
C17 H17 Cl F N
【MolWeight】
289.779
【Inchi】
InChI=1S/C17H17ClFN/c18-17-11-15(12-7-9-13(19)10-8-12)14-5-3-1-2-4-6-16(14)20-17/h7-11H,1-6H2
【InChIKey】
InChIKey=PWYYKWZKLRXRSM-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1c2cc(nc3c2CCCCCC3)Cl)F
【MOL File】
2-CHLORO-4-(4-FLUORO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:6.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-4-(4-FLUOROPHENYL)-5,6,7,8,9,10-HEXAHYDROCYCLOOCTA[B]PYRIDINE.cml