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3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 462612-73-3]

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CAS#: 462612-73-3
Product: 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
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Identification
Name 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
Molecular Structure CAS#: 462612-73-3, 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
Molecular Formula C16H13BrN2O4S
Molecular Weight 409.25
CAS Registry Number 462612-73-3
SMILES Brc2ccc(OCC(=O)NC(=S)Nc1cc(C(=O)O)ccc1)cc2
InChI 1S/C16H13BrN2O4S/c17-11-4-6-13(7-5-11)23-9-14(20)19-16(24)18-12-3-1-2-10(8-12)15(21)22/h1-8H,9H2,(H,21,22)(H2,18,19,20,24)
InChIKey SYUYQTHDMVUIFV-UHFFFAOYSA-N
Properties
Density 1.637g/cm3 (Cal.)
Refractive index 1.703 (Cal.)
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