1-(3-Hydroxypropyl)-1-[(5-nitrofuran-2-yl)methylideneamino]urea
Basic information
- CAS
5346-33-8- Standard SMILES
NC(=O)N(CCCO)N=Cc1ccc([N+](=O)[O-])o1- InChIKey
YRAXXSAIKVEZFO-UHFFFAOYSA-N- Molecular formula
- C9H12N4O5
- Average molar mass
- 256.22 g/mol
- Monoisotopic mass
- 256.0807695
Names & identifiers
- Preferred name
- 1-(3-Hydroxypropyl)-1-[(5-nitrofuran-2-yl)methylideneamino]urea
- IUPAC
- 1-(3-hydroxypropyl)-1-[(5-nitrofuran-2-yl)methylideneamino]urea
Names & synonyms
5346-33-81-(3-hydroxypropyl)-1-[(5-nitrofuran-2-yl)methylideneamino]ureaDTXSID302773041-(3-Hydroxypropyl)-2-[(5-nitrofuran-2-yl)methylidene]hydrazine-1-carboxamide
Database identifiers
- CAS
5346-33-8- PubChem CID
- 219828
- DTXSID
DTXSID30277304
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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