54340-59-9
QUINCARBATE
Name
QUINCARBATE
Formula
C17 H18 Cl N O6
MolWeight
367.783
1Identification
【Name】
QUINCARBATE
【CAS】
【MDL】
MFCD00867309
【English Synonyms】
【Formula】
C17 H18 Cl N O6
【MolWeight】
367.783
【Inchi】
InChI=1S/C17H18ClNO6/c1-3-22-7-9-8-24-16-12(25-9)5-11-13(14(16)18)15(20)10(6-19-11)17(21)23-4-2/h5-6,9H,3-4,7-8H2,1-2H3,(H,19,20)
【InChIKey】
InChIKey=AZOPNLGKZVSIIQ-UHFFFAOYSA-N
【SMILES】
CCOCC1COc2c(cc3c(c2Cl)c(=O)c(c[nH]3)C(=O)OCC)O1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
QUINCARBATE.cml
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