3-[(1-Carboxyvinyl)oxy]benzoic acid

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3-[(1-Carboxyvinyl)oxy]benzoic acid Basic information
Product Name:3-[(1-Carboxyvinyl)oxy]benzoic acid
Synonyms:3-[(1-Carboxyethenyl)oxy]benzoic acid;3-[(1-Carboxyvinyl)oxy]benzoic acid;Benzoic acid, 3-[(1-carboxyethenyl)oxy]-;Deoxydehydrochorismic acid >=95% (LC/MS-UV);Deoxydehydrochorismic acid
CAS:16929-37-6
MF:C10H8O5
MW:208.17
EINECS:
Product Categories:
Mol File:16929-37-6.mol
3-[(1-Carboxyvinyl)oxy]benzoic acid Structure
3-[(1-Carboxyvinyl)oxy]benzoic acid Chemical Properties
Melting point 150-152 °C
Boiling point 458.2±30.0 °C(Predicted)
density 1.401±0.06 g/cm3(Predicted)
storage temp. -20°C
solubility DMSO: 1mg/mL
form solid
pka3.26±0.11(Predicted)
Major Applicationmetabolomics
vitamins, nutraceuticals, and natural products
InChI1S/C10H8O5/c1-6(9(11)12)15-8-4-2-3-7(5-8)10(13)14/h2-5H,1H2,(H,11,12)(H,13,14)
InChIKeyHGVAHYJMDVROLE-UHFFFAOYSA-N
SMILESO=C(O)C1=CC=CC(OC(C(O)=O)=C)=C1
Safety Information
WGK Germany WGK 3
Storage Class11 - Combustible Solids
MSDS Information
3-[(1-Carboxyvinyl)oxy]benzoic acid Usage And Synthesis
Usesmetabolomics
vitamins, nutraceuticals, and natural products
DefinitionChEBI: 3-[(1-carboxyvinyl)oxy]benzoic acid is a dicarboxylic acid that is benzoic acid in which the hydrogen at position 3 is replaced by a (1-carboxyvinyl)oxy group. It is a member of benzoic acids, a dicarboxylic acid, an aromatic ether and an enol ether. It is functionally related to an acrylic acid. It is a conjugate acid of a 3-[(1-carboxylatovinyl)oxy]benzoate(2-).
3-[(1-Carboxyvinyl)oxy]benzoic acid Preparation Products And Raw materials
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