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631299

Sigma-Aldrich

3′,5′-Dinitroacetophenone

97%

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About This Item

Empirical Formula (Hill Notation):
C8H6N2O5
CAS Number:
14401-75-3
Molecular Weight:
210.14
MDL number:
MFCD00631987
UNSPSC Code:
12352100
PubChem Substance ID:
24882405
NACRES:
NA.22

Quality Level

100

assay

97%

mp

81-85 °C (lit.)

functional group

ketone
nitro

SMILES string

CC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O

InChI

1S/C8H6N2O5/c1-5(11)6-2-7(9(12)13)4-8(3-6)10(14)15/h2-4H,1H3

InChI key

WGJQPJOLPLYFJH-UHFFFAOYSA-N

Related Categories

pictograms

CorrosionExclamation mark
GHS05,GHS07

signalword

Danger

hcodes

H317,H318

Hazard Classifications

Eye Dam. 1 - Skin Sens. 1

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, Faceshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCD9910
MKCB2669V
MKBJ7601V
MKBG0019V
MKBD5779

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