Registration Dossier
Registration Dossier
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EC number: 406-530-2 | CAS number: - MDI
Reference substances
- IUPAC name:
- 1‐cyclohexyl‐3‐[4‐({4‐[(octadecylcarbamoyl)amino]phenyl}methyl)phenyl]urea
Inventory
Synonyms
- Names:
- (N-cyclohexyl-N-octadecyl-N'-phenyleneureido)methylene
- 3-cyclohexyl-1-(4-(4-(3-octadecylureido)benzyl)phenyl)urea
- 3-cyclohexyl-3'-octadecyl-1,1'-methylenebis(4,1-phenylene)diurea-
- CHA-MDI-ODA
- CHA-MDI-ODS
- MDI-CHA/ODA
- N''-[4-[4-(N'-Octadecylureido) phenyl]methyl] phenyl] cyclohexyl, urea
- N''-{4-[4-(N'-octadecylureido)phenylmethyl]-phenyl}-cyclohexyl urea
- N-[4-[[4-[[(Cyclohexylamino)carbonyl]amino]phenyl]methyl]phenyl]-N'-octadecylurea
- Identifier:
- IUPAC name
- 3-cyclohexyl-3'-octadecyl-1,1'-methylenebis(4,1-phenylene)diurea-
- Identifier:
- IUPAC name
- Urea, N-(4-((4-(((cyclohexylamino)carbonyl)amino)phenyl)methyl)phenyl)-N'-octadecyl-
- Identifier:
- other: Molecular formula
- C39H62N4O2
- Identifier:
- other: InChl
- InChI=1/C39H62N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-31-40-38(44)41-36-27-23-33(24-28-36)32-34-25-29-37(30-26-34)43-39(45)42-35-21-18-17-19-22-35/h23-30,35H,2-22,31-32H2,1H3,(H2,40,41,44)(H2,42,43,45)
- Identifier:
- other: SMILES notation
- O=C(NC1CCCCC1)Nc3ccc(Cc2ccc(NC(=O)NCCCCCCCCCCCCCCCCCC)cc2)cc3
Molecular and structural information
- Molecular formula:
- C39 H62 N4 O2
- Molecular weight:
- 618.94
- SMILES notation:
- CCCCCCCCCCCCCCCCCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NC3CCCCC3)cc2)cc1
- InChl:
- InChI=1S/C39H62N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-31-40-38(44)41-36-27-23-33(24-28-36)32-34-25-29-37(30-26-34)43-39(45)42-35-21-18-17-19-22-35/h23-30,35H,2-22,31-32H2,1H3,(H2,40,41,44)(H2,42,43,45)
- Structural formula:
Related substances
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