2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime
Basic information
- CAS
102206-42-8- Standard SMILES
O=C(Nc1ccc2c(c1)OCO2)O/N=C/c1ccccn1- InChIKey
SYJZGDIQJIDGDL-LZYBPNLTSA-N- Molecular formula
- C14H11N3O4
- Average molar mass
- 285.25 g/mol
- Monoisotopic mass
- 285.07495584
Names & identifiers
- Preferred name
- 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime
- IUPAC
- [(E)-pyridin-2-ylmethylideneamino] N-(1,3-benzodioxol-5-yl)carbamate
Names & synonyms
2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime102206-42-8RefChem:10646563,4-Methylenedioxy carbanilic acid, ester with picolinaldehyde oxime2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-ylamino)carbonyl)oxime
Database identifiers
- CAS
102206-42-8- PubChem CID
- 9554607
- Nikkaji
- J78.917H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…