ChemicalBook--->CAS DataBase List--->6310-09-4

6310-09-4

6310-09-4 Structure

6310-09-4 Structure
IdentificationMore
[Name]

2-ACETYL-5-CHLOROTHIOPHENE
[CAS]

6310-09-4
[Synonyms]

1-(5-CHLORO-2-THIENYL)ETHANONE
2-ACETYL-5-CHLOROTHIOPHENE
5-CHLORO-2-ACETYLTHIOPHENE
5-CHLORO-2-THIENYL METHYL KETONE
AKOS 93296
1-(5-chloro-2-thienyl)ethan-1-one
1-(5-Chloro-thiophen-2-yl)-ethanone
2-Acetyl-5-chlorthiophen
2-Chloro-5-acetylthiophene
5-Chlor-2-acetyl thiophen
5-chlor-2-acetylthiophen
5-Chloro-2-acetyl thiophen
5-chloro-2-acetylthiophen
BA 11044
ba11044
Ethanone, 1-(5-chloro-2-thienyl)-
Ethanone,1-(5-chloro-2-thienyl)-
Ketone, 5-chloro-2-thienyl methyl
ketone,5-chloro-2-thienylmethyl
2-Acetyl-5-chlorothiophene ,99%
[EINECS(EC#)]

228-630-3
[Molecular Formula]

C6H5ClOS
[MDL Number]

MFCD00005444
[Molecular Weight]

160.62
[MOL File]

6310-09-4.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powder
[Melting point ]

46-49 °C (lit.)
[Boiling point ]

117-118 °C/17 mmHg (lit.)
[density ]

1.3240 (estimate)
[Fp ]

227 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

Crystals or Crystalline Powder
[color ]

White to light yellow
[Sensitive ]

Light Sensitive
[Detection Methods]

HPLC
[BRN ]

113936
[InChI]

InChI=1S/C6H5ClOS/c1-4(8)5-2-3-6(7)9-5/h2-3H,1H3
[InChIKey]

HTZGPEHWQCRXGZ-UHFFFAOYSA-N
[SMILES]

C(=O)(C1SC(Cl)=CC=1)C
[CAS DataBase Reference]

6310-09-4(CAS DataBase Reference)
Safety DataBack Directory
[Risk Statements ]

20/21/22
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN2811
[WGK Germany ]

3
[RTECS ]

OB1745000
[REACH Registrations]

Active
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29349990
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Oral
Eye Irrit. 2
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Aluminum chloride-->Acetyl chloride-->2-Chlorothiophene-->Acetic anhydride
[Preparation Products]

4-broMo-5-chlorothiophene-2-carboxylic acid-->5-Chlorothiophene-2-carbonyl chloride-->Ethyl 3-(5-chlorothiophen-2-yl)-3-oxopropanoate
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powder
[Uses]

2-Acetyl-5-chlorothiophene serves as a precursor for synthesizing thiophene chalcones via Claisen-Schmidt condensation with heterocyclic or aromatic aldehydes, such as benzaldehyde, 4-chlorobenzaldehyde, and 2,4-dimethoxybenzaldehyde, in the presence of sodium hydroxide[6-8].
[Synthesis]

2-Chlorothiophene

96-43-5

Acetic anhydride

108-24-7

2-ACETYL-5-CHLOROTHIOPHENE

6310-09-4

Example 8: In a 100 mL four-necked flask equipped with a stirrer, a condenser, a thermometer, and a dropping funnel, 5.9 g of activated white clay (a product of Nacalai Tesque, Inc.) and 25.5 g (0.25 mol) of acetic anhydride were added sequentially. The temperature of the reaction system was maintained at 45 °C to 55 °C and 29.6 g (0.25 mol) of 2-chlorothiophene was slowly added dropwise over 1 h in this temperature range. After the dropwise addition was completed, the reaction was continued with stirring at 50 °C for 72 hours. Upon completion of the reaction, the activated white clay was removed by filtration to give a dark brown filtrate. Subsequently, unreacted 2-chlorothiophene, acetic anhydride and the by-product acetic acid were removed from the filtrate by distillation, resulting in 20.9 g (0.13 mol) of 2-acetyl-5-chlorothiophene.

[References]

[1] Patent: EP1695972, 2006, A1. Location in patent: Page/Page column 7
[2] Journal of the American Chemical Society, 1947, vol. 69, p. 3093,3095
[3] Journal of Organic Chemistry, 1948, vol. 13, p. 729,732
[4] Org. Synth. Coll. Vol. IV, <1963> 980,
[5] Journal of the American Chemical Society, 1947, vol. 69, p. 1014
Spectrum DetailBack Directory
[Spectrum Detail]

2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)MS
2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)1HNMR
2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)13CNMR
2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)IR1
2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)IR2
2-ACETYL-5-CHLOROTHIOPHENE(6310-09-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Acetyl-5-chlorothiophene, 99%(6310-09-4)
[Alfa Aesar]

2-Acetyl-5-chlorothiophene, 99%(6310-09-4)
[Sigma Aldrich]

6310-09-4(sigmaaldrich)
[TCI AMERICA]

2-Acetyl-5-chlorothiophene,>99.0%(GC)(6310-09-4)
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