284335

1,3-Dinitropyrene

99%

• Empirical Formula (Hill Notation): C₁₆H₈N₂O₄
• CAS Number: 75321-20-9
• Molecular Weight: 292.25
• MDL number: MFCD00010493
• UNSPSC Code: 12352100
• PubChem Substance ID: 24857149
• NACRES: NA.22

Properties

• Quality Level: 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

Description

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

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H302 + H312 + H332
• Precautionary Statements: P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves