1,3-Diisocyanato-2-methylbenzene;2,4-diisocyanato-1-methylbenzene;hexanedioic acid;hexane-1,6-diol

Base Information

• Chemical Name: 1,3-Diisocyanato-2-methylbenzene;2,4-diisocyanato-1-methylbenzene;hexanedioic acid;hexane-1,6-diol
• CAS No.: 67989-74-6
• Molecular Formula: C30H36N4O10
• Molecular Weight: 612.6276
• Mol file: 67989-74-6.mol

Synonyms:67989-74-6;(C9-H6-N2-O2.C9-H6-N2-O2.C6-H14-O2.C6-H10-O4)x-

Chemical Property of 1,3-Diisocyanato-2-methylbenzene;2,4-diisocyanato-1-methylbenzene;hexanedioic acid;hexane-1,6-diol

Chemical Property:

• Boiling Point: 251°Cat760mmHg
• Flash Point: 110.5°C
• PSA: 232.78000
• Density: g/cm³
• LogP: 5.10660
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 14
• Exact Mass: 612.24314336
• Heavy Atom Count: 44
• Complexity: 649

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O