2-(2-Nitroethyl)furan
Basic information
- CAS
5462-90-8- Standard SMILES
O=[N+]([O-])CCc1ccco1- InChIKey
CXQAMTGSMRTUTH-UHFFFAOYSA-N- Molecular formula
- C6H7NO3
- Average molar mass
- 141.12 g/mol
- Monoisotopic mass
- 141.04259309
Names & identifiers
- Preferred name
- 2-(2-Nitroethyl)furan
- IUPAC
- 2-(2-nitroethyl)furan
- English name
- 2-(2-NITRO-ETHYL)-FURAN
- Molecular formula
- C6H7NO3
- Molecular weight
- 141.12
Names & synonyms
2-(2-nitroethyl)furan5462-90-8Furan, 2-(2-nitroethyl)-2-(2-NITRO-ETHYL)-FURANFuran,2-(2-nitroethyl)-NSC16180starbld0044890SCHEMBL9277319DTXSID00280269ALBB-019776MFCD06738228NSC-16180
Show more names
AKOS BB-6912
AKOS000265934AKOS024255873VS-09927CS-0270940EN300-1672423
Database identifiers
- CAS
5462-90-8- PubChem CID
- 226090
- DTXSID
DTXSID00280269- Nikkaji
- J1.879.153F
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 121
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Related reactions
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Compound notes
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