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Carbamothioic acid, (4-bromophenyl)-, O-(2-benzoyl-4-nitrophenyl) ester

Base Information
  • Chemical Name:Carbamothioic acid, (4-bromophenyl)-, O-(2-benzoyl-4-nitrophenyl) ester
  • CAS No.:111044-15-6
  • Molecular Formula:C20H13 Br N2 O4 S
  • Molecular Weight:457.2972
  • Hs Code.:
  • DSSTox Substance ID:DTXSID00149463
  • Wikidata:Q83015238
Carbamothioic acid, (4-bromophenyl)-, O-(2-benzoyl-4-nitrophenyl) ester

Synonyms:O-(2-Benzoyl-4-nitrophenyl) (4-bromophenyl)carbamothioate;Carbamothioic acid, (4-bromophenyl)-, O-(2-benzoyl-4-nitrophenyl) ester;111044-15-6;C20H13BrN2O4S;DTXSID00149463;C20-H13-Br-N2-O4-S;LS-50819

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Chemical Property of Carbamothioic acid, (4-bromophenyl)-, O-(2-benzoyl-4-nitrophenyl) ester
Chemical Property:
  • Boiling Point:°Cat760mmHg 
  • Flash Point:°C 
  • Density:1.568g/cm3 
  • XLogP3:5.2
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:4
  • Exact Mass:455.97794
  • Heavy Atom Count:28
  • Complexity:593
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C3=C(C=CC(=C3)Br)NC(=O)S
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