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284335

1,3-Dinitropyrene

99%

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About This Item

Empirical Formula (Hill Notation):
C16H8N2O4
CAS Number:
75321-20-9
Molecular Weight:
292.25
NACRES:
NA.22
PubChem Substance ID:
24857149
UNSPSC Code:
12352100
MDL number:
MFCD00010493
Assay:
99%
Form:
solid
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Quality Segment

100

assay

99%

form

solid

solubility

DMSO: soluble 2 mg/mL, clear, yellow to orange

functional group

nitro

SMILES string

[O-][N+](=O)c1cc([N+]([O-])=O)c2ccc3cccc4ccc1c2c34

InChI

1S/C16H8N2O4/c19-17(20)13-8-14(18(21)22)12-7-5-10-3-1-2-9-4-6-11(13)16(12)15(9)10/h1-8H

InChI key

KTNUVDBUEAQUON-UHFFFAOYSA-N

General description

The carcinogenecity of 1,3-dinitropyrene was studied in newborn female rats.

Application

1,3-Dinitropyrene has been used in:
  • modification of the umu-assay (ISO 13829) to assess the cytotoxic potential of toxins
  • in vitro synthesis of 1,N6-etheno-2′-deoxyadenosine and 1,N2-etheno-2′-deoxyguanosine

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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