Basic information
- CAS
86358-13-6- Standard SMILES
O=C(O)CON=Cc1c(F)cccc1Cl- InChIKey
ATPDVKMQXRUTRC-UHFFFAOYSA-N- Molecular formula
- C9H7ClFNO3
- Average molar mass
- 231.61 g/mol
- Monoisotopic mass
- 231.0098489
Names & identifiers
- Preferred name
- ({[(2-Chloro-6-fluorophenyl)methylidene]amino}oxy)acetic acid
- IUPAC
- 2-[(2-chloro-6-fluorophenyl)methylideneamino]oxyacetic acid
Names & synonyms
86358-13-6SCHEMBL11138302DTXSID60705761({[(2-Chloro-6-fluorophenyl)methylidene]amino}oxy)acetic acidAKOS017394045
Database identifiers
- CAS
86358-13-6- PubChem CID
- 53661528
- DTXSID
DTXSID60705761
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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