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ChemicalBook--->CAS DataBase List--->13361-30-3

13361-30-3

13361-30-3 Structure

13361-30-3 Structure
IdentificationMore
[Name]

Isopropyl 2-cyanoacetate
[CAS]

13361-30-3
[Synonyms]

CYANOACETIC ACID ISOPROPYL ESTER
IPCY
ISOPROPYL 2-CYANOACETATE
ISOPROPYL CYANOACETATE
cyano-aceticaci1-methylethylester
cyano-aceticaciisopropylester
Acetic acid, cyano-, 1-methylethyl ester
2-Cyanoacetic acid isopropyl ester
[EINECS(EC#)]

236-421-3
[Molecular Formula]

C6H9NO2
[MDL Number]

MFCD00019842
[Molecular Weight]

127.14
[MOL File]

13361-30-3.mol
Chemical PropertiesBack Directory
[Boiling point ]

207 °C(lit.)
[density ]

1.013 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.416
[Fp ]

99°C
[form ]

clear liquid
[pka]

2.90±0.10(Predicted)
[color ]

Colorless to Almost colorless
[Specific Gravity]

1.01 (20/4℃)
[Water Solubility ]

Slightly soluble in water.
[BRN ]

1756014
[CAS DataBase Reference]

13361-30-3(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

2
[RTECS ]

AG4270000
[HS Code ]

29269090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Isopropyl alcohol
Hazard InformationBack Directory
[Uses]

Isopropyl cyanoacetate was used in the synthesis of 3-substituted coumarins by undergoing Kn?evenagel reactions with aldehydes and ketones.
[Synthesis Reference(s)]

Synthesis, p. 138, 1982 DOI: 10.1055/s-1982-29718
Spectrum DetailBack Directory
[Spectrum Detail]

Isopropyl 2-cyanoacetate(13361-30-3)MS
Isopropyl 2-cyanoacetate(13361-30-3)1HNMR
Isopropyl 2-cyanoacetate(13361-30-3)13CNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isopropyl 2-cyanoacetate, 97%(13361-30-3)
[Alfa Aesar]

Isopropyl cyanoacetate, 97%(13361-30-3)
[Sigma Aldrich]

13361-30-3(sigmaaldrich)
[TCI AMERICA]

Cyanoacetic Acid Isopropyl Ester,>97.0%(GC)(13361-30-3)
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