54221-93-1
2,6-DIMETHYLISONICOTINIC ACID
Name
2,6-DIMETHYLISONICOTINIC ACID
Formula
C8 H9 N O2
MolWeight
151.164
1Identification
【Name】
2,6-DIMETHYLISONICOTINIC ACID
【CAS】
【MDL】
MFCD03731176
【English Synonyms】
【Formula】
C8 H9 N O2
【MolWeight】
151.164
【Inchi】
InChI=1S/C8H9NO2/c1-5-3-7(8(10)11)4-6(2)9-5/h3-4H,1-2H3,(H,10,11)
【InChIKey】
InChIKey=JRJLLMLYUFAZOM-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(n1)C)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2,6-DIMETHYLISONICOTINIC ACID.cml
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