Basic information
- CAS
6312-92-1- Standard SMILES
CCCCCCCCCCCCCCCCNC(=O)Nc1ccc(C)c(NC(=O)NCCCCCCCCCCCCCCCC)c1- InChIKey
WSZDHTPDCLPVOM-UHFFFAOYSA-N- Molecular formula
- C41H76N4O2
- Average molar mass
- 657.1 g/mol
- Monoisotopic mass
- 656.59682768
Names & identifiers
- Preferred name
- 1,1'-(4-Methylbenzene-1,3-diyl)bis(3-hexadecylurea)
- IUPAC
- 1-hexadecyl-3-[3-(hexadecylcarbamoylamino)-4-methylphenyl]urea
- English name
- 1-hexadecyl-3-[5-(hexadecylcarbamoylamino)-2-methyl-phenyl]urea
- Molecular formula
- C41H76N4O2
- Molecular weight
- 657.07
Names & synonyms
6312-92-11,1'-(4-methylbenzene-1,3-diyl)bis(3-hexadecylurea)NSC40600DTXSID20285130NSC-40600N,N'-(4-Methyl-1,3-phenylene)bis(N'-hexadecylurea)Urea, 1,1'-(4-methyl-m-phenylene)bis[3-hexadecyl- (8CI)1-hexadecyl-3-[5-(hexadecylcarbamoylamino)-2-methyl-phenyl]urea
Database identifiers
- CAS
6312-92-1- PubChem CID
- 237264
- DTXSID
DTXSID20285130
Properties
Computed structural properties
- XLogP
- 15.8
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 32
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 703
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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