ChemicalBook--->CAS DataBase List--->617-90-3

617-90-3

617-90-3 Structure

617-90-3 Structure
IdentificationMore
[Name]

2-Furonitrile
[CAS]

617-90-3
[Synonyms]

2-CYANOFURAN
2-FURANCARBONITRILE
2-FURONITRILE
AKOS B004255
BUTTPARK 96\57-57
FURAN-2-CARBONITRILE
2-Furyl cyanide
alpha-Furyl cyanide
2-Furonitrile, 98+%
2-Cyanofurane
Furane-2-carbonitrile
2-Furonitrile, GC 99%
Pyromuconitrile
[EINECS(EC#)]

210-537-4
[Molecular Formula]

C5H3NO
[MDL Number]

MFCD00003223
[Molecular Weight]

93.08
[MOL File]

617-90-3.mol
Chemical PropertiesBack Directory
[Appearance]

Colorless to light yellow liqui
[Melting point ]

147-148 °C
[Boiling point ]

146-148 °C(lit.)
[density ]

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

n20/D 1.479(lit.)
[Fp ]

95 °F
[storage temp. ]

Flammables area
[form ]

Liquid
[color ]

Clear light yellow to light orange
[Specific Gravity]

1.06
[Water Solubility ]

Soluble in most common organic solvents. Slightly soluble in water.
[BRN ]

107033
[Exposure limits]

NIOSH: IDLH 25 mg/m3
[InChI]

1S/C5H3NO/c6-4-5-2-1-3-7-5/h1-3H
[InChIKey]

YXDXXGXWFJCXEB-UHFFFAOYSA-N
[SMILES]

N#Cc1ccco1
[LogP]

0.960
[CAS DataBase Reference]

617-90-3(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Furancarbonitrile(617-90-3)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R10:Flammable.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R41:Risk of serious damage to eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36/37:Wear suitable protective clothing and gloves .
S16:Keep away from sources of ignition-No smoking .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[Hazard Note ]

Harmful
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29299090
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Dam. 1
Flam. Liq. 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethyl acetate-->Diethyl ether-->Sodium sulfate-->Ammonium hydroxide-->Sodium chloride-->N-Bromosuccinimide-->Hydroxylamine hydrochloride-->Furfural-->N-Methyl-2-pyrrolidone
[Preparation Products]

2-Bromofuran-->5-(2-Furanyl)-1H-tetrazole-->Furan-2-amidoxime
Hazard InformationBack Directory
[Chemical Properties]

Colorless to light yellow liqui
[Uses]

2-Furonitrile is used as a extractive distillation solvent and as a sweetening agent. It is also used as an intermediate in pharmaceutical and fine chemical synthesis. 2-Furonitrile was employed as substrate to investigate the substrate specificity of nitrilase from Rhodococcus rhodochrous Jl cell.
[Synthesis Reference(s)]

Synthesis, p. 472, 1983 DOI: 10.1055/s-1983-30387
[General Description]

Infrared and Raman spectra of 2-furonitrile has been studied.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Furonitrile(617-90-3)1HNMR
2-Furonitrile(617-90-3)IR
2-Furonitrile(617-90-3)FT-IR
2-Furonitrile(617-90-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Furonitrile, 99%(617-90-3)
[Alfa Aesar]

2-Furonitrile, 98+%(617-90-3)
[Sigma Aldrich]

617-90-3(sigmaaldrich)
[TCI AMERICA]

2-Furonitrile,>98.0%(GC)(617-90-3)
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