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Structure

Acetonitrile N-oxide

CAS
7063-95-8
Catalog Number
ACM7063958
Category
Other Products
Molecular Weight
488.622820
Molecular Formula
C23H28N4O4S2

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Specification

Synonyms
CID5265258, CID 5265258, 7063-95-8
IUPAC Name
4-[5-[[2-(azepan-1-yl)-5-cyano-1-ethyl-4-methyl-6-oxopyridin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid
Canonical SMILES
C[C+]=N[O-]
InChI Key
ZBHMVGWNXSQCBN-UHFFFAOYSA-N
Boiling Point
549.9ºC at 760 mmHg
Flash Point
286.4ºC
Density
1.4g/cm³
Exact Mass
488.15500
H-Bond Acceptor
6
H-Bond Donor
1
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