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3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
[CAS# 462602-14-8]

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CAS#: 462602-14-8
Product: 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
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Identification
Name 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
Molecular Structure CAS#: 462602-14-8, 3-({[(4-Bromophenoxy)Acetyl]Carbamothioyl}Amino)-4-Methylbenzoic Acid
Molecular Formula C17H15BrN2O4S
Molecular Weight 423.28
CAS Registry Number 462602-14-8
SMILES Brc2ccc(OCC(=O)NC(=S)Nc1cc(C(=O)O)ccc1C)cc2
InChI 1S/C17H15BrN2O4S/c1-10-2-3-11(16(22)23)8-14(10)19-17(25)20-15(21)9-24-13-6-4-12(18)5-7-13/h2-8H,9H2,1H3,(H,22,23)(H2,19,20,21,25)
InChIKey ZXENQIMGNNDWQC-UHFFFAOYSA-N
Properties
Density 1.59g/cm3 (Cal.)
Refractive index 1.69 (Cal.)
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