CAS 117-52-2: Coumafuryl

Description: Coumafuryl, with the CAS number 117-52-2, is a chemical compound that belongs to the class of coumarins, which are known for their aromatic properties and presence in various natural products. This substance typically appears as a white to pale yellow crystalline solid. Coumafuryl is characterized by its distinct aromatic structure, which includes a fused benzene and α-pyrone ring system. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water. The compound exhibits biological activity, including potential anticoagulant properties, and has been studied for its effects in various pharmacological contexts. Additionally, coumafuryl may undergo various chemical reactions, such as oxidation and substitution, due to the presence of reactive functional groups. Safety data indicates that, like many chemical substances, it should be handled with care, as it may pose health risks upon exposure. Overall, coumafuryl is an interesting compound with applications in both research and potential therapeutic areas.

Formula: C₁₇H₁₄O₅

InChI: InChI=1S/C17H14O5/c1-10(18)9-12(13-7-4-8-21-13)15-16(19)11-5-2-3-6-14(11)22-17(15)20/h2-8,12,19H,9H2,1H3

InChI key: InChIKey=JFIXKFSJCQNGEK-UHFFFAOYSA-N

SMILES: O=C1OC=2C=CC=CC2C(O)=C1C(C=3OC=CC3)CC(=O)C

Synonyms:

• 2H-1-Benzopyran-2-one, 3-(1-(2-furanyl)-3-oxobutyl)-4-hydroxy-
• 3-(1-Furyl-3-acetylethyl)-4-hydroxycoumarin
• 3-(alpha-Acetonylfurfuryl)-4-hydroxycoumarin
• 3-(alpha-Furyl-beta-acetylaethyl)-4-hydroxycumarin
• 3-(alpha-Furyl-beta-acetylaethyl)-4-hydroxycumarin [German]
• 3-(α-Acetonylfurfuryl)-4-hydroxycoumarin
• 3-[1-(2-Furanyl)-3-oxobutyl]-4-hydroxy-2H-1-benzopyran-2-one
• 3-[1-(furan-2-yl)-3-oxobutyl]-2-hydroxy-4H-chromen-4-one
• 3-[1-(furan-2-yl)-3-oxobutyl]-4-hydroxy-2H-chromen-2-one
• 4-(2-Furyl)-4-(4-hydroxy-3-coumarinyl)-2-butanone
• 4-(2-Furyl)-4-(4-hydroxy-3-kumarinyl)-2-butanon
• 4-(2-Furyl)-4-(4-hydroxy-3-kumarinyl)-2-butanon [Czech]
• Brn 1395342
• Caswell No. 005
• Coumafuryl [ISO]
• Coumarin, 3-(alpha-acetonylfurfuryl)-4-hydroxy-
• Coumarin, 3-(α-acetonylfurfuryl)-4-hydroxy-
• Cumafuryl
• Cumafuryl [German]
• EPA Pesticide Chemical Code 086001
• Fumarin
• Fumarine
• Hsdb 7117
• Kill-Ko Rat
• Krumkil
• Kumatox
• Lurat
• Mouse blues
• Racemic coumafuryl
• Ratafin
• Tomarin
• 5-19-06-00391 (Beilstein Handbook Reference)
• Coumafuryl

2H-1-Benzopyran-2-one, 3-[1-(2-furanyl)-3-oxobutyl]-4-hydroxy-

CAS: 117-52-2

• Formula: C₁₇H₁₄O₅
• Color and Shape: Solid
• Molecular weight: 298.2901

Coumafuryl-d3

CAS: 117-52-2

• Formula: C₁₇H₁₁D₃O₅
• Color and Shape: White To Off-White Solid
• Molecular weight: 301.31

Coumafuryl

CAS: 117-52-2

• Formula: C₁₇H₁₄O₅
• Color and Shape: White To Off-White Solid
• Molecular weight: 298.29

Coumafuryl

CAS: 117-52-2

• Formula: C₁₇H₁₄O₅
• Color and Shape: Neat
• Molecular weight: 298.29

Coumafuryl 100 µg/mL in Cyclohexane

CAS: 117-52-2

• Formula: C₁₇H₁₄O₅
• Color and Shape: Single Solution
• Molecular weight: 298.29

Coumafuryl

CAS: 117-52-2

Applications Coumafuryl is similar to warfarin and displays anticoagulant activity. Its used as a rodenticide. …

• Formula: C₁₇H₁₄O₅
• Color and Shape: White
• Molecular weight: 298.29