1080-12-2 | 4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$6.00	$4.00
1g	98%	in stock	$8.00	$6.00
25g	98%	in stock	$123.00	$86.00
100g	98%	in stock	$359.00	$252.00

Description

• Catalog Number: AB65828
• Chemical Name: 4-(4-Hydroxy-3-methoxyphenyl)-3-buten-2-one
• CAS Number: 1080-12-2
• Molecular Formula: C11H12O3
• Molecular Weight: 192.2112
• MDL Number: MFCD00012210
• SMILES: COc1cc(/C=C/C(=O)C)ccc1O

Computed Properties

• Complexity: 223
• Covalently-Bonded Unit Count: 1
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 1.7

Upstream Synthesis Route

4-(4-Hydroxy-3-methoxyphenyl)but-3-en-2-one is a versatile compound widely utilized in chemical synthesis for its unique properties. This compound is commonly employed as a key intermediate in the synthesis of various pharmaceuticals, natural products, and bioactive compounds due to its functional groups and reactivity. Its aromatic ring and ketone functionality make it a valuable building block for the formation of more complex molecules through various synthetic pathways. Additionally, the hydroxy and methoxy groups present in the structure can serve as important sites for further chemical modifications, enabling the synthesis of a wide range of derivatives with diverse properties and applications in the field of medicinal chemistry and organic synthesis. This compound plays a crucial role in the development of new drug candidates, agrochemicals, and materials with specific desired properties. Its utilization in chemical synthesis highlights its significance as a strategic tool for accessing novel compounds with potential therapeutic, agricultural, or industrial applications.

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