Basic information
- CAS
57803-71-1- Standard SMILES
CCCCOc1cc(C(=O)NO)cc(OCCCC)n1- InChIKey
ILBINFKDNNTWSC-UHFFFAOYSA-N- Molecular formula
- C14H22N2O4
- Average molar mass
- 282.34 g/mol
- Monoisotopic mass
- 282.15795719
Names & identifiers
- Preferred name
- Isonicotinohydroxamic acid, 2,6-dibutoxy-
- IUPAC
- 2,6-dibutoxy-N-hydroxypyridine-4-carboxamide
- English name
- 2,6-Dibutoxy-4-pyridinecarbohydroximic acid
- Molecular formula
- C14H22N2O4
- Molecular weight
- 282.34
Names & synonyms
57803-71-1ISONICOTINOHYDROXAMIC ACID, 2,6-DIBUTOXY-BRN 04129572,6-Di-n-butoxyisonicotinohydroxamic acidDTXSID70206517RefChem:349704DTXCID001290082,6-dibutoxy-N-hydroxypyridine-4-carboxamide2,6-Dibutoxy-4-pyridinecarbohydroximic acidDB-2508904-Pyridinecarboxamide, 2,6-dibutoxy-N-hydroxy-
Database identifiers
- CAS
57803-71-1- PubChem CID
- 42573
- DTXSID
DTXSID70206517- Nikkaji
- J68.658A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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