Basic information
- CAS
21638-36-8- Standard SMILES
CC1CN(N=Cc2ccc([N+](=O)[O-])o2)C(=O)N1- InChIKey
BJUPUKIYTMVLCW-UHFFFAOYSA-N- Molecular formula
- C9H10N4O4
- Average molar mass
- 238.2 g/mol
- Monoisotopic mass
- 238.07020481
Names & identifiers
- Preferred name
- 4-Methyl-1-{[(5-nitrofuran-2-yl)methylidene]amino}imidazolidin-2-one
- IUPAC
- 4-methyl-1-[(5-nitrofuran-2-yl)methylideneamino]imidazolidin-2-one
Names & synonyms
NS001204144-methyl-1-{[(5-nitrofuran-2-yl)methylidene]amino}imidazolidin-2-one
Database identifiers
- CAS
21638-36-8- PubChem CID
- 30722
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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