5-[(3,5-Diethyl-4-isocyanatophenyl)methyl]-1,3-diethyl-2-isocyanatobenzene

Base Information

• Chemical Name: 5-[(3,5-Diethyl-4-isocyanatophenyl)methyl]-1,3-diethyl-2-isocyanatobenzene
• CAS No.: 105442-35-1
• Molecular Formula: C23H26 N2 O2
• Molecular Weight: 362.46
• Hs Code.: 2929109000
• European Community (EC) Number: 624-792-8
• DSSTox Substance ID: DTXSID30404830
• Nikkaji Number: J973.402C
• Mol file: 105442-35-1.mol

Synonyms:105442-35-1;5-[(3,5-diethyl-4-isocyanatophenyl)methyl]-1,3-diethyl-2-isocyanatobenzene;4,4'-Methylenebis(2,6-diethylphenyl isocyanate);4,4/'-DIISOCYANATO-3,3/',5,5/'-TETRAETHYLDIPHENYLMETHANE;SCHEMBL80318;DTXSID30404830;OQDCXRFLJMVOCC-UHFFFAOYSA-N;FT-0617060;4,4'-diisocyanato-3,3',5,5'-tetraethyldiphenylmethane;4,4'-Methylenebis(2,6-diethylphenyl isocyanate), 98%

Chemical Property of 5-[(3,5-Diethyl-4-isocyanatophenyl)methyl]-1,3-diethyl-2-isocyanatobenzene

Chemical Property:

• Melting Point: 55-57 °C(lit.)
• Boiling Point: 494.1±45.0 °C(Predicted)
• Flash Point: 203oC
• PSA: 58.86000
• Density: 1.04±0.1 g/cm3(Predicted)
• LogP: 5.46160
• XLogP3: 8.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 362.199428076
• Heavy Atom Count: 27
• Complexity: 475

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=CC(=C1N=C=O)CC)CC2=CC(=C(C(=C2)CC)N=C=O)CC