3-Nitro-2,6,7-Trimethyl-2H-1-Benzopyran
[CAS# 57543-83-6]

Identification

• Name: 3-Nitro-2,6,7-Trimethyl-2H-1-Benzopyran
• Synonyms: 2H-1-Benzopyran, 3-Nitro-2,6,7-Trimethyl-; 3-Nitro-2,6,7-Trimethyl-2H-1-Benzopyran; 5-17-02-00074 (Beilstein Handbook Reference)
• Molecular Formula: C₁₂H₁₃NO₃
• Molecular Weight: 219.24
• CAS Registry Number: 57543-83-6
• SMILES: C1=C(C(=CC2=C1C=C([N+]([O-])=O)C(O2)C)C)C
• InChI: 1S/C12H13NO3/c1-7-4-10-6-11(13(14)15)9(3)16-12(10)5-8(7)2/h4-6,9H,1-3H3
• InChIKey: DRQBSLQRAKLDGC-UHFFFAOYSA-N

Properties

• Density: 1.212g/cm³ (Cal.)
• Boiling point: 347.911°C at 760 mmHg (Cal.)
• Flash point: 154.28°C (Cal.)