Basic information
- Standard SMILES
CC(C)(C)OC(=O)COc1ccc(C(N)=NO)cc1F- InChIKey
NTYCHZFHNLSKJR-UHFFFAOYSA-N- Molecular formula
- C13H17FN2O4
- Average molar mass
- 284.28 g/mol
- Monoisotopic mass
- 284.11723519
Names & identifiers
- Preferred name
- Tert-butyl {4-[amino(hydroxyimino)methyl]-2-fluorophenoxy}acetate
- IUPAC
- tert-butyl 2-[2-fluoro-4-(N'-hydroxycarbamimidoyl)phenoxy]acetate
Names & synonyms
NTYCHZFHNLSKJR-UHFFFAOYSA-NTert-butyl {4-[amino(hydroxyimino)methyl]-2-fluoro phenoxy}acetateTert-butyl {4-[amino(hydroxyimino)methyl]-2-fluorophenoxy}acetate
Database identifiers
- PubChem CID
- 72307490
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 368
Related reactions
6 records
Compound notes
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