Basic information
- CAS
1083-59-6- Standard SMILES
O=[N+]([O-])c1ccc(C=Cc2ncccn2)o1- InChIKey
QYWCIRZOGSMFAW-UHFFFAOYSA-N- Molecular formula
- C10H7N3O3
- Average molar mass
- 217.18 g/mol
- Monoisotopic mass
- 217.04874109
Names & identifiers
- Preferred name
- 2-[2-(5-Nitro-2-furanyl)ethenyl]pyrimidine
- IUPAC
- 2-[2-(5-nitrofuran-2-yl)ethenyl]pyrimidine
Names & synonyms
1083-59-6SCHEMBL10643025DTXSID808761892-[2-(5-Nitro-2-furanyl)ethenyl]pyrimidine2-[2-(5-Nitrofuran-2-yl)ethen-1-yl]pyrimidine
Database identifiers
- CAS
1083-59-6- PubChem CID
- 286753
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 271
Experimental & physicochemical properties
LogP1.34
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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