Basic information
- Standard SMILES
CCOC(=O)C(=NOC)C(CC(C)C)C(C)=O- InChIKey
AURADFMZLUCYCD-UHFFFAOYSA-N- Molecular formula
- C12H21NO4
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.14705815
Names & identifiers
- Preferred name
- 3-Acetyl-2-methoxyimino-5-methyl-hexanoic acid ethyl ester
- IUPAC
- ethyl 3-acetyl-2-methoxyimino-5-methylhexanoate
Names & synonyms
SCHEMBL2770831AURADFMZLUCYCD-UHFFFAOYSA-N3-Acetyl-2-methoxyimino-5-methyl-hexanoic acid ethyl ester
Database identifiers
- PubChem CID
- 76540076
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 297
Related reactions
3 records
Compound notes
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