Basic information
- CAS
136132-29-1- Standard SMILES
CC(C)c1ccc(N(Cc2cccc([N+](=O)[O-])c2)C(=O)N(C)C)cc1- InChIKey
BMXMPXMVTXMLLV-UHFFFAOYSA-N- Molecular formula
- C19H23N3O3
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.1739416
Names & identifiers
- Preferred name
- Urea, N,N-dimethyl-N'-(4-(1-methylethyl)phenyl)-N'-((3-nitrophenyl)methyl)-
- IUPAC
- 1,1-dimethyl-3-[(3-nitrophenyl)methyl]-3-(4-propan-2-ylphenyl)urea
Names & synonyms
Urea, N,N-dimethyl-N'-(4-(1-methylethyl)phenyl)-N'-((3-nitrophenyl)methyl)-136132-29-1DTXSID80159681N,N-Dimethyl-N'-[(3-nitrophenyl)methyl]-N'-[4-(propan-2-yl)phenyl]urea
Database identifiers
- CAS
136132-29-1- PubChem CID
- 178285
- DTXSID
DTXSID80159681
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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