| Identification | Back Directory | [Name]
1,3-DINITROBENZENE (13C6) | [CAS]
201595-60-0 | [Synonyms]
13C6]-1,3-Dinitrobenzene
1,3-DINITROBENZENE (13C6)
1,3-DINITROBENZENE-13C6, 99 ATOM % 13C
1,3-DINITROBENZENE (13C6, 99%) 1 MG/ML IN ACETONITRILE
1,3-dinitro(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-triene | [Molecular Formula]
C6H4N2O4 | [MDL Number]
MFCD00142531 | [MOL File]
201595-60-0.mol | [Molecular Weight]
174.16 |
| Chemical Properties | Back Directory | [Melting point ]
88-90 °C (lit.) | [Boiling point ]
297 °C (lit.) | [density ]
1.416 g/mL at 25 °C | [Fp ]
150℃ | [solubility ]
soluble in Dichloromethane | [form ]
Solid | [color ]
Off-white | [InChI]
1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1 | [InChIKey]
WDCYWAQPCXBPJA-IDEBNGHGSA-N | [SMILES]
[O-][N+](=O)[13c]1[13cH][13cH][13cH][13c]([13cH]1)[N+]([O-])=O | [CAS Number Unlabeled]
99-65-0 |
| Safety Data | Back Directory | [Hazard Codes ]
T+ | [Risk Statements ]
5-26/27/28-33-40 | [Safety Statements ]
22-36/37/39-45 | [RIDADR ]
UN 3443 6.1/PG 2 | [WGK Germany ]
3 | [Storage Class]
6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials | [Hazard Classifications]
Acute Tox. 1 Dermal
Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Aquatic Acute 1
Aquatic Chronic 1
STOT RE 2 |
| Hazard Information | Back Directory | [Uses]
1,3-Dinitrobenzene-13C6 is an intermediate in the synthesis of Hexachlorobenzene-13C6 (H290817). Hexachlorobenzene-13C6 , is the labeled analogue of Hexachlorobenzene, which is a fungicide formerly used as a seed treatment, especially on wheat to control the fungal disease bunt. |
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