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Key Documents

415766

Sigma-Aldrich

2′-Hydroxy-5′-methyl-3′-nitroacetophenone

99%

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About This Item

Linear Formula:
HOC6H2(CH3)(NO2)COCH3
CAS Number:
Molecular Weight:
195.17
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

99%

mp

133-136 °C (lit.)

SMILES string

CC(=O)c1cc(C)cc(c1O)[N+]([O-])=O

InChI

1S/C9H9NO4/c1-5-3-7(6(2)11)9(12)8(4-5)10(13)14/h3-4,12H,1-2H3

InChI key

XSHQMMIEZHWNAK-UHFFFAOYSA-N

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


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Aromatic solvent effect on the rotational isomerism in 2-hydroxy-5-methyl-3-nitroacetophenone.
Konopacka A, et al.
Journal of Physical Organic Chemistry, 18(12), 1190-1195 (2005)
Densities and ultrasonic speed of 2-hydroxy-5-methyl-3-nitro acetophenone in N,N-dimethylformamide at different temperatures.
Aswar AS and Choudhary DS.
Bulletin of the Chemical Society of Ethiopia, 27(1), 155-160 (2012)

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