Basic information
- CAS
68084-56-0- Standard SMILES
CCCCCCCCCCCCN(C(=O)Nc1ccc(Cc2ccc(NC(=O)N(CCCCCCCCCCCC)c3ccccc3)cc2)cc1)c1ccccc1- InChIKey
QIXVMYNRGNEHRU-UHFFFAOYSA-N- Molecular formula
- C51H72N4O2
- Average molar mass
- 773.1 g/mol
- Monoisotopic mass
- 772.56552755
Names & identifiers
- Preferred name
- Urea, N,N''-(methylenedi-4,1-phenylene)bis(N'-(dodecylphenyl)-
- IUPAC
- 1-dodecyl-3-[4-[[4-[[dodecyl(phenyl)carbamoyl]amino]phenyl]methyl]phenyl]-1-phenylurea
- English name
- N,N''-(methylenedi-p-phenylene)bis[N'-(dodecylphenyl)urea]
- Molecular formula
- C51H72N4O2
- Molecular weight
- 773.14298
Names & synonyms
4,4'-Bis(dodecylphenylurea)diphenylmethaneEINECS 268-447-6Urea, N,N''-(methylenedi-4,1-phenylene)bis(N'-(dodecylphenyl)-COAZJVUJPNHHPX-UHFFFAOYSA-NNS00120767N,N''-(Methylenedi-p-phenylene)bis(N'-(dodecylphenyl)urea)N,N''-(methylenedi-p-phenylene)bis[N'-(dodecylphenyl)urea]
Database identifiers
- CAS
68084-56-0- PubChem CID
- 106567
Properties
Computed structural properties
- XLogP
- 16.5
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 28
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 915
Physicochemical properties
- EPA Substance Registry System
- Urea, N,N''-(methylenedi-4,1-phenylene)bis[N'-(dodecylphenyl)- (68084-56-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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