2-(Acetyloxy)-Benzoic Acid 3-[(Nitrooxy)Methyl]Phenyl Ester
[CAS# 175033-36-0]

Identification

• Name: 2-(Acetyloxy)-Benzoic Acid 3-[(Nitrooxy)Methyl]Phenyl Ester
• Synonyms: [3-(Nitrooxymethyl)Phenyl] 2-Acetoxybenzoate; 2-Acetoxybenzoic Acid [3-(Nitrooxymethyl)Phenyl] Ester; 2-Acetoxybenzoic Acid 3-(Nitrooxymethyl)Phenyl Ester
• Molecular Formula: C₁₆H₁₃NO₇
• Molecular Weight: 331.28
• CAS Registry Number: 175033-36-0
• SMILES: C1=C(C(=CC=C1)OC(=O)C)C(OC2=CC(=CC=C2)CO[N+]([O-])=O)=O
• InChI: 1S/C16H13NO7/c1-11(18)23-15-8-3-2-7-14(15)16(19)24-13-6-4-5-12(9-13)10-22-17(20)21/h2-9H,10H2,1H3
• InChIKey: IOJUJUOXKXMJNF-UHFFFAOYSA-N

Properties

• Density: 1.347g/cm³ (Cal.)
• Boiling point: 499.269°C at 760 mmHg (Cal.)
• Flash point: 214.33°C (Cal.)