5-Bromo-4-methoxythiophene-3-carboxylic acid

Base Information

• Chemical Name: 5-Bromo-4-methoxythiophene-3-carboxylic acid
• CAS No.: 162848-23-9
• Molecular Formula: C₆H₅BrO₃S
• Molecular Weight: 237.074
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID50380900
• Wikidata: Q72446500
• Mol file: 162848-23-9.mol

Synonyms:5-bromo-4-methoxythiophene-3-carboxylic acid;162848-23-9;5-Bromo-4-methoxythiophene-3-carboxylicacid;Maybridge3_003417;SCHEMBL2745234;DTXSID50380900;OMNYIQIDPSRNES-UHFFFAOYSA-N;HMS1440L07;MFCD00068031;AKOS015898670;CCG-250502;DS-0984;FS-3249;IDI1_014804;CS-0207191;FT-0620141;2-Bromo-3-methoxythiophene-4-carboxylic acid;5-bromo-4-methoxy-thiophene-3-carboxylic acid;EN300-2193795;A810417;W-205914;BRD-K86073251-001-01-3;BRD-K86073251-001-04-7

Chemical Property of 5-Bromo-4-methoxythiophene-3-carboxylic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 155 °C
• Refractive Index: 1.615
• Boiling Point: 333.087 °C at 760 mmHg
• PKA: 3.68±0.30(Predicted)
• Flash Point: 155.246 °C
• PSA: 74.77000
• Density: 1.801 g/cm³
• LogP: 2.21740
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 235.91428
• Heavy Atom Count: 11
• Complexity: 164

Purity/Quality:

98%min ^*data from raw suppliers

5-Bromo-4-methoxythiophene-3-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xi:Irritant
• Statements: 36/37/38-20/21/22
• Safety Statements: 26-36/37/39-22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(SC=C1C(=O)O)Br