Lot numbers can be found on the outside label of a product:
3-Hydroxy-4-methoxyacetophenone
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CAS No. 6100-74-9
- Cat. No. CS-W002484
- Purity≥98%
- MDL No.MFCD00182975
*For research and further manufacturing use only, not for direct human use.
Structure of 6100-74-9
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General Information
- CAS No. 6100-74-9
- Cat. No. CS-W002484
- Purity ≥98%
- MDL No. MFCD00182975
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₁₀O₃
- Molecular Weight None
- Synonym(s) Acetoisovanillone; Isoacetovanillone
- SMILES CC(C1=CC=C(OC)C(O)=C1)=O
Description
3-Hydroxy-4-methoxyacetophenone features a strategically positioned hydroxyl group and methoxy substituent that enhance solubility and reactivity in synthetic transformations. This electron-rich scaffold serves as a key intermediate in the construction of bioactive molecules and functionalized aromatic systems under standard conditions.
Application
3-Hydroxy-4-methoxyacetophenone serves as a versatile building block in synthetic organic chemistry, enabling access to substituted phenolic scaffolds and bioactive heterocycles. Its ortho-hydroxyl and para-methoxy functional groups provide orthogonal reactivity for derivatization, while the ketone moiety facilitates aldol condensations, nucleophilic additions, and cyclization reactions. Bench-stable and readily purified by recrystallization, it functions effectively in multi-step synthesis workflows requiring predictable regioselectivity and functional group compatibility.
Synthesis
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Route1
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88114-44-7 - ~83%
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In-stock
6100-74-9
References
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CRYPTOPHARMA PTY LTD Patent: WO2008/124878 A1, 2008 ; Location in patent: Page/Page column 38 ;
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Route2
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In-stock
1197-09-7 -
74-88-4 - ~92%
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In-stock
6100-74-9
References
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Wymann, Walter E.; Davis, Roman; Patterson, John W.; Pfister, Juerg R. Synthetic Communications, 1988 , vol. 18, # 12 p. 1379 - 1384
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References
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Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, , vol. 21, # 3 p. 186 - 188
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302
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Precautionary Statements : P264-P270-P330-P501
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Quality Control
Computational Chemistry Data
- TPSA 46.53
- LogP 1.6034
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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