ChemicalBook--->CAS DataBase List--->20893-30-5

20893-30-5

20893-30-5 Structure

20893-30-5 Structure
IdentificationMore
[Name]

2-Thiopheneacetonitrile
[CAS]

20893-30-5
[Synonyms]

2-Cyanomethylthiophene
2-THIENYLACETONITRILE
2-THIOPHENEACETONITRILE
thien-2-ylacetonitrile
THIOPHENE-2-ACETONITRILE
thiophen-2-acetonitrile
2-Thiopheneacetonitrile, tech., 94%
2-(2-Thienyl)acetonitrile
[EINECS(EC#)]

244-104-6
[Molecular Formula]

C6H5NS
[MDL Number]

MFCD00005453
[Molecular Weight]

123.18
[MOL File]

20893-30-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless to slightly brown liquid
[Melting point ]

50-51 °C
[Boiling point ]

115-120 °C/22 mmHg (lit.) 235-238 °C (lit.)
[density ]

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

n20/D 1.542(lit.)
[Fp ]

215 °F
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

clear liquid
[color ]

Colorless to Light orange to Yellow
[Specific Gravity]

1.157
[BRN ]

106960
[InChI]

InChI=1S/C6H5NS/c7-4-3-6-2-1-5-8-6/h1-2,5H,3H2
[InChIKey]

CLSHQIDDCJTHAJ-UHFFFAOYSA-N
[SMILES]

C1(CC#N)SC=CC=1
[CAS DataBase Reference]

20893-30-5(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Thiopheneacetonitrile(20893-30-5)
[EPA Substance Registry System]

20893-30-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi,T
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

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

UN 3276 6.1/PG 3
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

T
[REACH Registrations]

Active
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29349990
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Thien-2-ylacetonitrile(20893-30-5).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colourless to slightly brown liquid
[Uses]

2-Thiopheneacetonitrile was used as reagent during the synthesis of monodisperse Au/Au@polythiophene core/shell nanospheres.
[Definition]

ChEBI: A nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a 2-thienyl group.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 15, p. 81, 1950 DOI: 10.1021/jo01147a014
Synthesis, p. 40, 1987 DOI: 10.1055/s-1987-27834
Spectrum DetailBack Directory
[Spectrum Detail]

2-Thiopheneacetonitrile(20893-30-5)MS
2-Thiopheneacetonitrile(20893-30-5)1HNMR
2-Thiopheneacetonitrile(20893-30-5)13CNMR
2-Thiopheneacetonitrile(20893-30-5)IR1
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Thiopheneacetonitrile, 96%(20893-30-5)
[Sigma Aldrich]

20893-30-5(sigmaaldrich)
[TCI AMERICA]

Thiophene-2-acetonitrile,>98.0%(GC)(20893-30-5)
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