Methyl N-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Carbamothioyl]Carbamate
[CAS# 129625-34-9]

Identification

• Name: Methyl N-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Carbamothioyl]Carbamate
• Synonyms: N-[[[2-Nitro-4-(Trifluoromethyl)Phenyl]Amino]-Thioxomethyl]Carbamic Acid Methyl Ester; N-[[2-Nitro-4-(Trifluoromethyl)Phenyl]Thiocarbamoyl]Carbamic Acid Methyl Ester; Carbamic Acid, (((2-Nitro-4-(Trifluoromethyl)Phenyl)Amino)Thioxomethyl)-, Methyl Ester
• Molecular Formula: C₁₀H₈F₃N₃O₄S
• Molecular Weight: 323.25
• CAS Registry Number: 129625-34-9
• SMILES: C1=CC(=CC(=C1NC(NC(OC)=O)=S)[N+]([O-])=O)C(F)(F)F
• InChI: 1S/C10H8F3N3O4S/c1-20-9(17)15-8(21)14-6-3-2-5(10(11,12)13)4-7(6)16(18)19/h2-4H,1H3,(H2,14,15,17,21)
• InChIKey: SOBJHZWSIPYINO-UHFFFAOYSA-N

Properties

• Density: 1.58g/cm³ (Cal.)