Urea, N-((4-methylphenyl)methyl)-N-nitroso-
Basic information
- CAS
87096-66-0- Standard SMILES
Cc1ccc(CN(N=O)C(N)=O)cc1- InChIKey
VTUQHLQIPPTZTE-UHFFFAOYSA-N- Molecular formula
- C9H11N3O2
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.0851266
Names & identifiers
- Preferred name
- Urea, N-((4-methylphenyl)methyl)-N-nitroso-
- IUPAC
- 1-[(4-methylphenyl)methyl]-1-nitrosourea
Names & synonyms
Urea, N-((4-methylphenyl)methyl)-N-nitroso-87096-66-0N-((4-Methylphenyl)methyl)-N-nitrosoureaN-[(4-Methylphenyl)methyl]-N-nitrosoureaDTXSID202361221-(4-Methylbenzyl)-1-nitrosourea
Database identifiers
- CAS
87096-66-0- PubChem CID
- 174607
- DTXSID
DTXSID20236122
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 75.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
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Compound notes
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