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Home >> Chemical Listing >> Page 1753 >> 5-Iodo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid

5-Iodo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 532980-93-1]

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CAS#: 532980-93-1
Product: 5-Iodo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
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Identification
Name 5-Iodo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Structure CAS#: 532980-93-1, 5-Iodo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C15H10IN3O5S
Molecular Weight 471.23
CAS Registry Number 532980-93-1
SMILES S=C(Nc1ccc(I)cc1C(=O)O)NC(=O)c2cccc([N+]([O-])=O)c2
InChI 1S/C15H10IN3O5S/c16-9-4-5-12(11(7-9)14(21)22)17-15(25)18-13(20)8-2-1-3-10(6-8)19(23)24/h1-7H,(H,21,22)(H2,17,18,20,25)
InChIKey DUMBTNFZUXPQPS-UHFFFAOYSA-N
Properties
Density 1.923g/cm3 (Cal.)
Refractive index 1.779 (Cal.)
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