856852-28-3
1,4-DIHYDRO-1-METHYL-4-[(PIPERIDINOTHIOCARBONYL)METHYLENE]-PYRIDINE
Name1,4-DIHYDRO-1-METHYL-4-[(PIPERIDINOTHIOCARBONYL)METHYLENE]-PYRIDINE
1Identification
【Name】
1,4-DIHYDRO-1-METHYL-4-[(PIPERIDINOTHIOCARBONYL)METHYLENE]-PYRIDINE
【CAS】
【MDL】
MFCD17018075
【English Synonyms】
【Formula】
C13 H18 N2 S
【MolWeight】
234.365
【Inchi】
InChI=1S/C13H18N2S/c1-14-9-5-12(6-10-14)11-13(16)15-7-3-2-4-8-15/h5-6,9-11H,2-4,7-8H2,1H3
【InChIKey】
InChIKey=GNOPZXKOXRWPNB-UHFFFAOYSA-N
【SMILES】
CN1C=CC(=CC(=S)N2CCCCC2)C=C1
【MOL File】
1,4-DIHYDRO-1-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIHYDRO-1-METHYL-4-[(PIPERIDINOTHIOCARBONYL)METHYLENE]-PYRIDINE.cml