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Structure

Benzeneacetic acid,a-cyano-2-nitro-4-(trifluoromethyl)-,methyl ester

CAS
13544-05-3
Catalog Number
ACM13544053
Category
Other Products
Molecular Weight
288.18
Molecular Formula
C11H7F3N2O4

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Specification

Synonyms
METHYL 2-CYANO-2-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]ACETATE;Methylcyanonitrotrifluoromethylphenylacetate;Methyl 2-cyano-2-[2-nitro-4-(trifluoromethyl)phenyl]acetate 97%;Methyl2-cyano-2-[2-nitro-4-(trifluoromethyl)phenyl]acetate97%
IUPAC Name
methyl 2-cyano-2-[2-nitro-4-(trifluoromethyl)phenyl]acetate
Canonical SMILES
COC(=O)C(C#N)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]
InChI Key
HDRIGUQRECFCAK-UHFFFAOYSA-N
Boiling Point
381.2ºC at 760mmHg
Flash Point
184.4ºC
Density
1.453g/cm³
Exact Mass
288.03600
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
8
H-Bond Donor
0
Safety Description
26-36/37/39
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