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Structure

4-Nitrophenacyl thiocyanate

CAS
6097-21-8
Catalog Number
ACM6097218
Category
Other Products
Molecular Weight
222.22
Molecular Formula
C9H6N2O3S

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Specification

Synonyms
4-NITROPHENACYL THIOCYANATE;1-(4-NITRO-PHENYL)-2-THIOCYANATO-ETHANONE;4-NITROPHENACYL THIOCYANATE, 95+%
IUPAC Name
[2-(4-nitrophenyl)-2-oxoethyl] thiocyanate
Canonical SMILES
C1=CC(=CC=C1C(=O)CSC#N)[N+](=O)[O-]
InChI Key
YDZIDXSUWKPPNJ-UHFFFAOYSA-N
Boiling Point
416.7ºC at 760 mmHg
Flash Point
205.8ºC
Density
1.418g/cm³
Exact Mass
222.01000
H-Bond Acceptor
4
H-Bond Donor
0
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