ChemicalBook--->CAS DataBase List--->16563-14-7

16563-14-7

16563-14-7 Structure

16563-14-7 Structure
IdentificationBack Directory
[Name]

4-CYANO-3-TETRAHYDROTHIOPHENONE
[CAS]

16563-14-7
[Synonyms]

Nsc298357
Cyanotetrahydrothiophenone
4-oxothiolane-3-carbonitrile
4-Cyanotetrahydro-3-thiophenone
4-CYANO-3-TETRAHYDROTHIOPHENONE
4-CYANO-3-OXOTETRAHYDROTHIOPHENE
4-CYANO-3-TETRAHYDROTHIOPHENONE 98+%
3-Oxotetrahydrothiophene-4-carbonitrile
4-OXOTETRAHYDROTHIOPHENE-3-CARBONITRILE
[Molecular Formula]

C5H5NOS
[MDL Number]

MFCD00059049
[MOL File]

16563-14-7.mol
[Molecular Weight]

127.16
Chemical PropertiesBack Directory
[Melting point ]

71 °C
[Boiling point ]

125 °C / 1mmHg
[density ]

1.29
[storage temp. ]

2-8°C(protect from light)
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[color ]

White to Light yellow
[CAS DataBase Reference]

16563-14-7
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2934.99.9001
[HazardClass ]

IRRITANT
Hazard InformationBack Directory
[Uses]

4-CYANO-3-TETRAHYDROTHIOPHENONE is used as a precursor for α-substituted acrylonitriles, 2-cyano-1,3-butadiene, and substituted thiophenes; building block for thienobenzodiazepines.
[Preparation]

4-Cyano-3-tetrahydrothiophenone can be conveniently prepared in 50% yield by cyclization of the Michael adduct of methyl thioglycolate and acrylonitrile.
Spectrum DetailBack Directory
[Spectrum Detail]

4-CYANO-3-TETRAHYDROTHIOPHENONE(16563-14-7)MS
4-CYANO-3-TETRAHYDROTHIOPHENONE(16563-14-7)1HNMR
4-CYANO-3-TETRAHYDROTHIOPHENONE(16563-14-7)IR1
4-CYANO-3-TETRAHYDROTHIOPHENONE(16563-14-7)IR2
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