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ChemicalBook--->CAS DataBase List--->5048-19-1

5048-19-1

5048-19-1 Structure

5048-19-1 Structure
IdentificationMore
[Name]

5-HEXENENITRILE
[CAS]

5048-19-1
[Synonyms]

1-CYANO-4-PENTENE
5-CYANO-1-PENTENE
5-HEXENENITRILE
5-Hexenenitrile,97%
5-Hexenenitrile, GC 97%
5-HEXENENITRILE 95%
[EINECS(EC#)]

624-976-8
[Molecular Formula]

C6H9N
[MDL Number]

MFCD00067056
[Molecular Weight]

95.14
[MOL File]

5048-19-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to pale yellow liquid
[Boiling point ]

165 °C (lit.)
[density ]

0.837 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.427(lit.)
[Fp ]

105 °F
[solubility ]

Chloroform, Methanol (Slightly)
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Specific Gravity]

0.820.837
[Water Solubility ]

Insoluble in water. Soluble in alcohol.
[BRN ]

1739773
[Stability:]

Stable under recommended storage conditions., Stable Under Recommended Storage C
[LogP]

1.407 (est)
[CAS DataBase Reference]

5048-19-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R37/38:Irritating to respiratory system and skin .
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 1993 3/PG 1
[WGK Germany ]

3
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29269095
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to pale yellow liquid
[Uses]

5-Hexenenitrile may be used in the synthesis of 1,8-dicyano-4-octene.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 70, p. 3707, 1948 DOI: 10.1021/ja01191a047
[General Description]

5-Hexenenitrile, an aliphatic nitrile, is a volatile compound that is formed as a degradation product of glucobrassicanapin in Aurinia sinuata. It is reported to be an attractant from oilseed rape for the cabbage seed weevil, Ceutorhynchus assimilis. 5-Hexenenitrile is the main volatile compound found in wheat extract. It undergoes Wacker oxidation to form the corresponding methyl ketone using PdCl2-DMA (palladium dichloride-N,N-diemthylacetamide) catalytic system.
Spectrum DetailBack Directory
[Spectrum Detail]

5-HEXENENITRILE(5048-19-1)MS
5-HEXENENITRILE(5048-19-1)1HNMR
5-HEXENENITRILE(5048-19-1)13CNMR
5-HEXENENITRILE(5048-19-1)IR1
5-HEXENENITRILE(5048-19-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-Hexenenitrile, 95%(5048-19-1)
[Alfa Aesar]

5-Hexenenitrile, 97%(5048-19-1)
[Sigma Aldrich]

5048-19-1(sigmaaldrich)
[TCI AMERICA]

5-Hexenenitrile,>95.0%(GC)(5048-19-1)
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