1,6-Diisocyanatohexane;2,4-diisocyanato-1-methylbenzene

Base Information

• Chemical Name: 1,6-Diisocyanatohexane;2,4-diisocyanato-1-methylbenzene
• CAS No.: 26426-91-5
• Deprecated CAS: 128000-11-3
• Molecular Formula: C17H18N4O4
• Molecular Weight: 342.3492
• European Community (EC) Number: 927-271-6,642-372-2
• DSSTox Substance ID: DTXSID80926052
• Mol file: 26426-91-5.mol

Synonyms:128000-11-3;26426-91-5;1,6-diisocyanatohexane;2,4-diisocyanato-1-methylbenzene;SCHEMBL1345815;DTXSID80926052;HEXAMETHYLENE DIISOCYANATE;TOLUENE DIISOCYANATE;1,6-Diisocyanatohexane--2,4-diisocyanato-1-methylbenzene (1/1)

Chemical Property of 1,6-Diisocyanatohexane;2,4-diisocyanato-1-methylbenzene

Chemical Property:

• Boiling Point: 251°Cat760mmHg
• Flash Point: 110.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 342.13280507
• Heavy Atom Count: 25
• Complexity: 434

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O.C(CCCN=C=O)CCN=C=O

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