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5-Iodo-2-{[(Trichloroacetyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 536984-63-1]

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CAS#: 536984-63-1
Product: 5-Iodo-2-{[(Trichloroacetyl)Carbamothioyl]Amino}Benzoic Acid
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Identification
Name 5-Iodo-2-{[(Trichloroacetyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Structure CAS#: 536984-63-1, 5-Iodo-2-{[(Trichloroacetyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C10H6Cl3IN2O3S
Molecular Weight 467.49
CAS Registry Number 536984-63-1
SMILES S=C(Nc1ccc(I)cc1C(=O)O)NC(=O)C(Cl)(Cl)Cl
InChI 1S/C10H6Cl3IN2O3S/c11-10(12,13)8(19)16-9(20)15-6-2-1-4(14)3-5(6)7(17)18/h1-3H,(H,17,18)(H2,15,16,19,20)
InChIKey PFYXFALYGQTHDS-UHFFFAOYSA-N
Properties
Density 2.109g/cm3 (Cal.)
Refractive index 1.751 (Cal.)
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