BENZOTHIOPHENE-4-CARBOXYLIC ACID
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BENZOTHIOPHENE-4-CARBOXYLIC ACID
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CAS No:
10134-95-9
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Formula:
C9H6O2S
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Chemical Name:
BENZOTHIOPHENE-4-CARBOXYLIC ACID
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Synonyms:
AKOS BC-0215;BENZOTHIOPHENE-4-CARBOXYLIC ACID;BENZO[B]THIOPHENE-7-CARBOXYLIC ACID;Fs002050;4-Benzothiophenecarboxylic acid;Benzo[b]thiophene-4-carboxylic acid;1-benzothiophene-4-carboxylic acid
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CAS No:
Characteristics
65.5
2.5
1.419±0.06 g/cm3 (20 ºC 760 Torr)
188-189℃
376.2±15.0 °C(Predicted)
181.3±20.4 °C
1.717
BENZOTHIOPHENE-4-CARBOXYLIC ACID Use and Manufacturing
2-{5-Chloro-2-[3-(4-methylpiperazin-1-yl)-propylamino]-pyrimidin-4-yl}-benzo[b]thiophene-4-carboxylic acid cyclopropylamide tri-hydrochloride(A). Preparation of benzo[b]thiophene-4-carboxylic acid; A few crystals of iodine are added to a stirred suspension of magnesium (Mg) (4.79 g, 197 mmol) in anhydrous THF (100 mL) under nitrogen atmosphere, then a solution of 4-bromo-benzo-thiophene (40.0 g, 188 mmol) in anhydrous THF (150 mL) is added dropwise. Initially only 5percent of the total amount is added (ca. 1 mL) to start the reaction, after that the rest of the amount is added at the rate to keep the reaction temperature around 50-55° C. This takes around 30 minutes and finally the reaction is heated at 50° C. for 1 hour. When most of the Mg is consumed, the reaction is cooled to 23° C. and CO
Computed Properties
Molecular Weight:178.21
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:178.00885060
Monoisotopic Mass:178.00885060
Topological Polar Surface Area:65.5
Heavy Atom Count:12
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of BENZOTHIOPHENE-4-CARBOXYLIC ACID
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Business licensed Certified factoryManufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acidInquiryCAS No.: 10134-95-9Grade: Industrial GradeContent: 95%
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BENZOTHIOPHENE-4-CARBOXYLIC ACID
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