Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(Cl)c(OCC2CCCO2)c1- InChIKey
YWFXXSHMRNMYMC-UHFFFAOYSA-N- Molecular formula
- C11H12ClNO4
- Average molar mass
- 257.67 g/mol
Names & identifiers
- Preferred name
- 2-(2-Chloro-5-nitro-phenoxymethyl)-tetrahydrofuran
- IUPAC
- 2-[(2-chloro-5-nitrophenoxy)methyl]oxolane
Names & synonyms
769961-19-5SCHEMBL4360550YWFXXSHMRNMYMC-UHFFFAOYSA-NAKOS018038846DA-029322-(2-Chloro-5-nitro-phenoxymethyl)-tetrahydrofuran
Database identifiers
- PubChem CID
- 69016050
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Related reactions
4 records
Compound notes
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