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1-Isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one

Base Information
  • Chemical Name:1-Isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one
  • CAS No.:26761-25-1
  • Molecular Formula:(C15H10N2O2·C6H10O2)x
  • Molecular Weight:364.3945
  • Hs Code.:
  • DSSTox Substance ID:DTXSID50949576
  • Mol file:26761-25-1.mol
1-Isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one

Synonyms:26761-25-1;DTXSID50949576;(C15-H10-N2-O2.C6-H10-O2)x-;Oxepan-2-one--1,1'-methylenebis(4-isocyanatobenzene) (1/1)

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Chemical Property of 1-Isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one
Chemical Property:
  • Boiling Point:373.4°Cat760mmHg 
  • Flash Point:154°C 
  • PSA:85.16000 
  • Density:g/cm3 
  • LogP:4.31560 
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:6
  • Rotatable Bond Count:4
  • Exact Mass:364.14230712
  • Heavy Atom Count:27
  • Complexity:420
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
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