C9H15NO2
169.22 g/mol
Industrial ChemicalWarning
Hexyl cyanoacetate
CAS13361-53-0EC236-426-0
Category
Industrial Chemical
Compound Class
Ester
Primary Use
Chemical intermediate for syntheses
Hexyl cyanoacetate is an organic compound used primarily as a chemical intermediate in industrial syntheses. It features ester and nitrile functional groups, contributing to its reactivity in organic reactions.
Chemical intermediate for syntheses
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
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StrongStructure SimilarSimilarity 0.85
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liquid crystal 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
Customs Tariff Classification
The international HS code for Hexyl cyanoacetate (CAS 13361-53-0) is 2926.90.
HS code (international, 6-digit)
2926.90
EU CN code (8-digit)
2926 90 70
Classification per the EU customs inventory ECICS (2026-07 snapshot, HS 2022). National tariff lines and product form can affect the final classification.
Identifiers
IUPAC Name
hexyl 2-cyanoacetate
InChIKey
PWKKBTPSCGLYBR-UHFFFAOYSA-N
SMILES
CCCCCCOC(=O)CC#N
Synonyms (6)
- Cyanoacetic acid, hexyl ester
- Hexyl cyanoacetate
- hexyl 2-cyanoacetate
- n-hexyl cyanoacetate
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