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Home >> Chemical Listing >> Page 1745 >> 3,5-Dibromo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid

3,5-Dibromo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 530127-30-1]

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CAS#: 530127-30-1
Product: 3,5-Dibromo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
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Identification
Name 3,5-Dibromo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Structure CAS#: 530127-30-1, 3,5-Dibromo-2-{[(3-Nitrobenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C15H9Br2N3O5S
Molecular Weight 503.12
CAS Registry Number 530127-30-1
SMILES Brc2cc(Br)cc(c2NC(=S)NC(=O)c1cccc([N+]([O-])=O)c1)C(=O)O
InChI 1S/C15H9Br2N3O5S/c16-8-5-10(14(22)23)12(11(17)6-8)18-15(26)19-13(21)7-2-1-3-9(4-7)20(24)25/h1-6H,(H,22,23)(H2,18,19,21,26)
InChIKey JSLXNCXVGKWVAB-UHFFFAOYSA-N
Properties
Density 1.97g/cm3 (Cal.)
Refractive index 1.761 (Cal.)
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