ChemicalBook > CAS DataBase List > Benzofuran-5-carboxylic acid

Benzofuran-5-carboxylic acid

Product Name
Benzofuran-5-carboxylic acid
CAS No.
90721-27-0
Chemical Name
Benzofuran-5-carboxylic acid
Synonyms
RARECHEM AL BE 1369;5-Benzofurancarboxylic acid;Benzofuran-5-carboxylic acid;1-benzofunan-5-carboxylic acid;1-BENZOFURAN-5-CARBOXYLIC ACID;Benzo[b]furan-5-carboxylic acid;3a,7a-dihydrobenzofuran-5-carboxylic acid;1-Benzofuran-5-carboxylic acid, 5-Carboxybenzo[b]furan
CBNumber
CB7224021
Molecular Formula
C9H6O3
Formula Weight
162.14
MOL File
90721-27-0.mol
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Benzofuran-5-carboxylic acid Property

Melting point:
189-190°C
Boiling point:
325.6±15.0 °C(Predicted)
Density 
1.363±0.06 g/cm3(Predicted)
storage temp. 
2-8°C
form 
solid
pka
4.06±0.30(Predicted)
Appearance
Off-white to yellow Solid
InChI
InChI=1S/C9H6O3/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5H,(H,10,11)
InChIKey
GTWXSZIQNTUNKR-UHFFFAOYSA-N
SMILES
O1C2=CC=C(C(O)=O)C=C2C=C1
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-37/39
HS Code 
2932990090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

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N-Bromosuccinimide Price

TRC
Product number
B207738
Product name
1-Benzofuran-5-carboxylicacid
Packaging
1g
Price
$100
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB142796
Product name
Benzofuran-5-carboxylic acid
Packaging
1g
Price
$104
Updated
2021/12/16
AK Scientific
Product number
Y4644
Product name
1-Benzofuran-5-carboxylicacid
Packaging
1g
Price
$137
Updated
2021/12/16
Matrix Scientific
Product number
100717
Product name
1-Benzofuran-5-carboxylic acid
Packaging
1g
Price
$163
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB142796
Product name
Benzofuran-5-carboxylic acid
Packaging
2g
Price
$181
Updated
2021/12/16
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Benzofuran-5-carboxylic acid Chemical Properties,Usage,Production

Chemical Properties

white to light yellow crystal powde

Synthesis

108763-47-9

90721-27-0

General procedure for the synthesis of 1-benzofuran-5-carboxylic acid from methyl benzofuran-5-carboxylate: Methyl benzofuran-5-carboxylate (1.3 g, 7.38 mmol) was dissolved in methanol (51 mL), 5% aqueous sodium hydroxide solution (41 mL) was added, and the mixture was stirred. The reaction mixture was heated to 65 °C and kept at this temperature for 4 hours. After completion of the reaction, the mixture was cooled to room temperature and the methanol was removed by distillation under reduced pressure. The remaining aqueous phase was extracted with dichloromethane and the organic phase was discarded. The aqueous phase was acidified with concentrated hydrochloric acid to pH=1 and then extracted with chloroform. The organic phases were combined, washed with deionized water, dried over anhydrous magnesium sulfate, filtered and concentrated under reduced pressure to give 1.2 g (98% yield) of 1-benzofuran-5-carboxylic acid as a white solid.1H NMR (400 MHz, DMSO-d6) δ 12.9, 8.30, 8.11, 7.92, 7.69, 7.09.

References

[1] Patent: US2003/232853, 2003, A1. Location in patent: Page 37
[2] Patent: WO2004/39815, 2004, A2. Location in patent: Page 70
[3] Patent: WO2017/155909, 2017, A1. Location in patent: Paragraph 0182
[4] Bioorganic and Medicinal Chemistry, 2018, vol. 26, # 8, p. 1797 - 1809
[5] Journal of Medicinal Chemistry, 1995, vol. 38, # 16, p. 3094 - 3105

Benzofuran-5-carboxylic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from Benzofuran-5-carboxylic acid manufacturers

Nanjing jinheyou Trading Co., Ltd.
Product
Benzofuran-5-carboxylic acid 90721-27-0
Price
US $0.00/g
Min. Order
1g
Purity
95%min
Supply Ability
20kg/month
Release date
2019-12-23
Career Henan Chemical Co
Product
Benzofuran-5-carboxylic acid 90721-27-0
Price
US $1.00/KG
Min. Order
1KG
Purity
97-99%
Supply Ability
1000KGS
Release date
2019-12-18