2-(5-Fluoro-2,4-dinitrophenoxy)acetic acid
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Basic information
- CAS
2923-61-7- Standard SMILES
O=C(O)COc1cc(F)c([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
IXQKJKRSNBANCS-UHFFFAOYSA-N- Molecular formula
- C8H5FN2O7
- Average molar mass
- 260.13 g/mol
- Monoisotopic mass
- 260.00807872
Names & identifiers
- Preferred name
- 2-(5-Fluoro-2,4-dinitrophenoxy)acetic acid
- IUPAC
- 2-(5-fluoro-2,4-dinitrophenoxy)acetic acid
Names & synonyms
2-(5-fluoro-2,4-dinitrophenoxy)acetic acid2923-61-7NSC190635SCHEMBL9863292SCHEMBL29537950DTXSID60307284IXQKJKRSNBANCS-UHFFFAOYSA-NMFCD30490625NSC-1906352,4-dinitro-5-fluorophenoxyacetic acid(5-Fluoro-2,4-dinitrophenoxy)acetic acidD84448
Database identifiers
- CAS
2923-61-7- PubChem CID
- 302891
- DTXSID
DTXSID60307284
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 352
Related reactions
2 records
Compound notes
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