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2-Acetylthio-4'-nitroacetophenone 97

CAS
351003-18-4
Catalog Number
ACM351003184
Category
Other Products
Molecular Weight
239.25
Molecular Formula
C6H5(NO2)COCH2SCOCH3

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Specification

Synonyms
351003-18-4, AC1MMF6W, CTK4H3615, 2-Acetylthio-4-nitroacetophenone, AG-F-20750, KB-227276, S-[2-(4-nitrophenyl)-2-oxoethyl] ethanethioate, Ethanethioic acid,S-[2-(4-nitrophenyl)-2-oxoethyl] ester, 2-ACETYLTHIO-4AA inverted exclamation markAA -NITROACETOPHENONE 97
IUPAC Name
S-[2-(4-nitrophenyl)-2-oxoethyl] ethanethioate
Canonical SMILES
CC(=O)SCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
InChI Key
BVCPSCSGSCDJDI-UHFFFAOYSA-N
Melting Point
51-55ºC(lit.)
Flash Point
>230 °F
Exact Mass
239.02500
H-Bond Acceptor
5
H-Bond Donor
0
WGK Germany
3
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