2-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Thio]-Benzoicacid
[CAS# 1545-75-1]

Identification

• Name: 2-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Thio]-Benzoicacid
• Synonyms: 2-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Thio]Benzoate; Zinc02872929
• Molecular Formula: C₁₄H₇F₃NO₄S
• Molecular Weight: 342.27
• CAS Registry Number: 1545-75-1
• SMILES: C1=C(C(F)(F)F)C=CC(=C1[N+]([O-])=O)SC2=C(C([O-])=O)C=CC=C2
• InChI: 1S/C14H8F3NO4S/c15-14(16,17)8-5-6-12(10(7-8)18(21)22)23-11-4-2-1-3-9(11)13(19)20/h1-7H,(H,19,20)/p-1
• InChIKey: MXLQVAQMSZOUEX-UHFFFAOYSA-M

Properties

• Boiling point: 421.633°C at 760 mmHg (Cal.)
• Flash point: 208.797°C (Cal.)