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Merck
CN

428531

5-(4-Chlorophenyl)-2-furoic acid

97%

Synonym(s):

5-(4-Chlorophenyl)-2-furancarboxylic acid

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About This Item

Empirical Formula (Hill Notation):
C11H7ClO3
CAS Number:
Molecular Weight:
222.62
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
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Product Name

5-(4-Chlorophenyl)-2-furoic acid, 97%

InChI

1S/C11H7ClO3/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H,13,14)

SMILES string

OC(=O)c1ccc(o1)-c2ccc(Cl)cc2

InChI key

XIPQHWUSDHTXOO-UHFFFAOYSA-N

assay

97%

mp

198-201 °C (dec.) (lit.)

General description

5-(4-Chlorophenyl)-2-furoic acid (5-(4-chlorophenyl)-2-furancarboxylic acid) is a 5-aryl-2-furancarboxylic acid. It has been synthesized by oxidation of the corresponding furaldehyde with silver nitrate and sodium hydroxide. It serves as an intermediate for the synthesis of 5-(5-aryl-2-furyl)-tetrazol-1-ylacetic acids, which are employed in the synthesis of semisynthetic cephalosporines.

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Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Semisynthetic cephalosporines. I. An improved synthesis of 5-aryl-2-furancarboxylic acids.
Janda L and Voticky Z.
Chemical Papers, 38(4), 507-513 (1984)

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