Basic information
- CAS
54680-35-2- Standard SMILES
CCN(N=O)C(=O)Nc1ccccc1- InChIKey
YMTQXQUODAPKBB-UHFFFAOYSA-N- Molecular formula
- C9H11N3O2
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.0851266
Names & identifiers
- Preferred name
- 1-Ethyl-1-nitroso-3-phenylurea
- IUPAC
- 1-ethyl-1-nitroso-3-phenylurea
Names & synonyms
1-Ethyl-1-nitroso-3-phenylurea54680-35-2Urea, 1-ethyl-1-nitroso-3-phenyl-1-Ethyl-3-phenyl-1-nitrosourea99PH778F3SNSC-83099N-ETHYL-N-NITROSO-N'-PHENYLUREACCRIS 9192NSC 83099BRN 2109383NSC830990-12-00-00366 (Beilstein Handbook Reference)
Show more names
UNII-99PH778F3SDTXSID80203138N-Ethyl-N-nitroso-N'-phenyl-ureaUrea, N-ethyl-N-nitroso-N'-phenyl-ETHYL-1-NITROSO-3-PHENYLUREA, 1-
Database identifiers
- CAS
54680-35-2- PubChem CID
- 93299
- DTXSID
DTXSID80203138- UNII
- 99PH778F3S
- Nikkaji
- J87.719K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Experimental & physicochemical properties
LogP2.25
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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