Basic information
- CAS
59163-42-7- Standard SMILES
CCC(=O)OC(OC(=O)CC)c1ccc([N+](=O)[O-])o1- InChIKey
CXMOCYBDLXOVJC-UHFFFAOYSA-N- Molecular formula
- C11H13NO7
- Average molar mass
- 271.22 g/mol
- Monoisotopic mass
- 271.06920175
Names & identifiers
- Preferred name
- (5-Nitrofuran-2-yl)methylene dipropionate
- IUPAC
- [(5-nitrofuran-2-yl)-propanoyloxymethyl] propanoate
Names & synonyms
59163-42-7(5-Nitrofuran-2-yl)methylene dipropionateNSC74651DTXSID40974594NSC-74651(5-Nitrofuran-2-yl)methylene dipropanoate
Database identifiers
- CAS
59163-42-7- PubChem CID
- 252579
- DTXSID
DTXSID40974594
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 333
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…