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: C(CC(C)=O)(C1=C(O)C=2C(OC1=O)=CC=CC2)C3=CC=CO3

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-d3

CAS: 117-52-2

Formula: C₁₇H₁₁D₃O₅

Color and Shape: White To Off-White Solid

Molecular weight: 301.31

Ref: 4Z-C-373001

Coumafuryl

CAS: 117-52-2

Formula: C₁₇H₁₄O₅

Color and Shape: White To Off-White Solid

Molecular weight: 298.29

Ref: 4Z-C-373002

Coumafuryl 100 µg/mL in Cyclohexane

Controlled Product

CAS: 117-52-2

Formula: C₁₇H₁₄O₅

Color and Shape: Single Solution

Molecular weight: 298.29

Ref: 04-XA11720000CY

Coumafuryl

Controlled Product

CAS: 117-52-2

Formula: C₁₇H₁₄O₅

Color and Shape: Neat

Molecular weight: 298.29

Ref: 04-C11720000

Coumafuryl

Controlled Product

CAS: 117-52-2

Applications Coumafuryl is similar to warfarin and displays anticoagulant activity. Its used as a rodenticide.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Marek, L. et al.: J. Agric. Food Chem., 55, 571 (2007); Marsalek, P. et al.: Analytical Bioanal. Chem., 407, 7849 (2015);

Formula: C₁₇H₁₄O₅

Color and Shape: White

Molecular weight: 298.29

Ref: TR-C765603

Coumafuryl

CAS: 117-52-2

Coumafuryl is a coumarin-based rodenticide. It inhibits the metabolic cycle of vitamin K, thereby interfering with the biosynthesis of vitamin K-dependent clotting factors (factors II, VII, IX, and X) in the liver.

Formula: C₁₇H₁₄O₅

Color and Shape: Solid

Molecular weight: 298.29

Ref: TM-TN10400

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

Ref: IN-DA000DIM