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Benzofuran-2-carboxylic acid - 99%, high purity , CAS No.496-41-3
Basic Description Synonyms Benzofuran-2-carboxylic acid|496-41-3|Coumarilic acid|1-Benzofuran-2-carboxylic acid|Benzo[b]furan-2-carboxylic acid|2-BENZOFURANCARBOXYLIC ACID|Coumarone-2-carboxylic acid|2-Carboxybenzofuran|benzofuran-2-carboxylicacid|MFCD00005848|Benzo(b)furan-2-carbo Specifications & Purity ≥99% Storage Temp Room temperature Shipped In Normal Product Description Benzofuran-2-carboxylic acid was used in the synthesis of the oxymethyl-modified coumarinic acid-based cyclic DADLE (H-Tyr-D-Ala-Gly-Phe-D-Leu-OH) prodrug
Names and Identifiers Pubchem Sid 488181117 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488181117 IUPAC Name 1-benzofuran-2-carboxylic acid INCHI InChI=1S/C9H6O3/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-5H,(H,10,11) InChi Key OFFSPAZVIVZPHU-UHFFFAOYSA-N Canonical SMILES C1=CC=C2C(=C1)C=C(O2)C(=O)O Isomeric SMILES C1=CC=C2C(=C1)C=C(O2)C(=O)O WGK Germany 3 RTECS DF6490000 PubChem CID 10331 Molecular Weight 162.14 Beilstein 124204 Reaxy-Rn 124204
Chemical and Physical Properties Solubility Soluble in Methanol,Acetone,Ethanol; Slightly soluble in Chloroform Boil Point(°C) 310-315° Melt Point(°C) 195 °C
Safety and Hazards(GHS) Pictogram(s) GHS07 Signal Warning Hazard Statements H315: Causes skin irritation
H319: Causes serious eye irritation
H335: May cause respiratory irritation
Precautionary Statements P261: Avoid breathing dust/fume/gas/mist/vapors/spray.
P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing.
P280: Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352: IF ON SKIN: wash with plenty of water.
P321: Specific treatment (see ... on this label).
P405: Store locked up.
P501: Dispose of contents/container to ...
P264: Wash hands [and …] thoroughly after handling.
P271: Use only outdoors or in a well-ventilated area.
P304+P340: IF INHALED: Remove person to fresh air and keep comfortable for breathing.
P403+P233: Store in a well-ventilated place. Keep container tightly closed.
P362+P364: Take off contaminated clothing and wash it before reuse.
P264+P265: Wash hands [and …] thoroughly after handling. Do not touch eyes.
P337+P317: If eye irritation persists: Get medical help.
P332+P317: If skin irritation occurs: Get medical help.
P319: Get medical help if you feel unwell.
WGK Germany 3 RTECS DF6490000 Reaxy-Rn 124204 Merck Index 2561
References 1. Xiang Y, Hirth B, Asmussen G, Biemann HP, Bishop KA, Good A, Fitzgerald M, Gladysheva T, Jain A, Jancsics K et al. . (2011) The discovery of novel benzofuran-2-carboxylic acids as potent Pim-1 inhibitors.. Bioorg Med Chem Lett, 21 (10): (3050-6). [PMID:21507633 ]
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