80018-06-0
FENGABINE
Name
FENGABINE
Formula
C17 H17 Cl2 N O
MolWeight
322.233
1Identification
【Name】
FENGABINE
【CAS】
【MDL】
MFCD00865430
【English Synonyms】
【Formula】
C17 H17 Cl2 N O
【MolWeight】
322.233
【Inchi】
InChI=1S/C17H17Cl2NO/c1-2-3-10-20-17(13-6-4-5-7-15(13)19)14-11-12(18)8-9-16(14)21/h4-9,11,21H,2-3,10H2,1H3/b20-17+
【InChIKey】
InChIKey=ZGLIFVFRIOKQLE-LVZFUZTISA-N
【SMILES】
CCCC/N=C(\c1ccccc1Cl)/c2cc(ccc2O)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
FENGABINE.cml
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