C11H19NO2
197.27 g/mol
Industrial ChemicalWarning
Octyl cyanoacetate
CAS15666-97-4EC629-113-9
Category
Industrial Chemical
Compound Class
Ester
Primary Use
Chemical intermediate for synthesis
Octyl cyanoacetate is an ester compound containing a nitrile group, used primarily as a chemical intermediate in organic synthesis. Its structure consists of an octyl chain esterified with cyanoacetic acid, making it a versatile building block for producing various specialty chemicals.
Chemical intermediate for synthesis
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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Related Compounds
StrongStructure SimilarSimilarity 1.00
Acetic acid, cyano-, hexyl ester
CAS13361-53-0
Chemical intermediate for syntheses
StrongStructure SimilarSimilarity 0.85
Butyl cyanoacetate
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pharmaceutical intermediate
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Solvent for cleaning and coatings
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Solvent for paints, lacquers, and cleaning products
ReferenceSame Category
Cyclohexyl mercaptan
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thiol intermediate for synthesis
ReferenceSame Category
Ethyl 2-cyanopropionate
CAS1572-99-2
chemical intermediate
Safety Reference
Warning
H302Harmful if swallowed
H312Harmful in contact with skin
H315Causes skin irritation
H319Causes serious eye irritation
H332Harmful if inhaled
H335May cause respiratory irritation
Identifiers
IUPAC Name
octyl 2-cyanoacetate
InChIKey
MBCTWXWDQMXVDF-UHFFFAOYSA-N
SMILES
CCCCCCCCOC(=O)CC#N
Synonyms (6)
- Cyanoacetic acid, octyl ester
- Octyl 2-cyanoacetate
- Octyl cyanoacetate
- n-Octyl cyanoacetate
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