1,3-Dioxo-2-benzofuran-5-carboxylic acid;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Base Information

• Chemical Name: 1,3-Dioxo-2-benzofuran-5-carboxylic acid;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
• CAS No.: 25053-57-0
• Deprecated CAS: 132702-80-8,67167-62-8,41238-64-6,127564-25-4,154640-60-5,176206-76-1,1428326-28-6,2577265-51-9
• Molecular Formula: (C15H10N2O2·C9H4O5)x
• Molecular Weight: 442.37716
• DSSTox Substance ID: DTXSID80925909
• Mol file: 25053-57-0.mol

Synonyms:25053-57-0;DTXSID80925909;(C15-H10-N2-O2.C9-H4-O5)x-;1,3-Dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid--1,1'-methylenebis(4-isocyanatobenzene) (1/1);127564-25-4

Chemical Property of 1,3-Dioxo-2-benzofuran-5-carboxylic acid;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Chemical Property:

• Boiling Point: 373.4°Cat760mmHg
• Flash Point: 154°C
• PSA: 139.53000
• Density: g/cm³
• LogP: 3.90740
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 442.08010079
• Heavy Atom Count: 33
• Complexity: 640

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O

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