Basic information
- CAS
136132-33-7- Standard SMILES
CC(C)c1ccc(N(Cc2ccc(Cl)c([N+](=O)[O-])c2)C(=O)N(C)C)cc1- InChIKey
XXFRHQDGPZGWMS-UHFFFAOYSA-N- Molecular formula
- C19H22ClN3O3
- Average molar mass
- 375.8 g/mol
- Monoisotopic mass
- 375.1349693
Names & identifiers
- Preferred name
- Urea, 3-((4-chloro-3-nitrophenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)-
- IUPAC
- 1-[(4-chloro-3-nitrophenyl)methyl]-3,3-dimethyl-1-(4-propan-2-ylphenyl)urea
Names & synonyms
Urea, 3-((4-chloro-3-nitrophenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)-136132-33-7DTXSID201596853-((4-Chloro-3-nitrophenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)ureaN-[(4-Chloro-3-nitrophenyl)methyl]-N',N'-dimethyl-N-[4-(propan-2-yl)phenyl]urea
Database identifiers
- CAS
136132-33-7- PubChem CID
- 178289
- DTXSID
DTXSID20159685
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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