ethyl (2Z)-2-cyano-2-methoxyiminoacetate
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Basic information
- CAS
114314-17-9- Standard SMILES
CCOC(=O)/C(C#N)=N\OC- InChIKey
MZGFKQBLSUREHL-YVMONPNESA-N- Molecular formula
- C6H8N2O3
- Average molar mass
- 156.14 g/mol
- Monoisotopic mass
- 156.05349212
Names & identifiers
- Preferred name
- ethyl (2Z)-2-cyano-2-methoxyiminoacetate
- IUPAC
- ethyl (2Z)-2-cyano-2-methoxyiminoacetate
- English name
- Acetic acid, cyano(methoxyimino)-, ethyl ester, (Z)- (9CI)
- Molecular formula
- C6H8N2O3
- Molecular weight
- 156.14
Names & synonyms
114314-17-9ethyl (2Z)-2-cyano-2-methoxyiminoacetateSCHEMBL9481912Acetic acid, cyano(methoxyimino)-, ethyl ester, (Z)- (9CI)
Database identifiers
- CAS
114314-17-9- PubChem CID
- 5466522
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 71.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 213
Physicochemical properties
- Boiling point
- 195 · 195.0±23.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
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Compound notes
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