Lot numbers can be found on the outside label of a product:
Methyl 4-methylanthranilate
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CAS No. 18595-17-0
- Cat. No. CS-0028743
- Purity≥98%
- MDL No.MFCD09998260
*For research and further manufacturing use only, not for direct human use.
Structure of 18595-17-0
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General Information
- CAS No. 18595-17-0
- Cat. No. CS-0028743
- Purity ≥98%
- MDL No. MFCD09998260
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₁₁NO₂
- Molecular Weight 165.19
- Synonym(s) Methyl 2-amino-4-methylbenzoate
- SMILES O=C(OC)C1=CC=C(C)C=C1N
Description
Methyl 4-methylanthranilate delivers a distinct floral aroma with a fruity undertone, serving as a key fragrance compound in perfumery and flavor formulations. This bench-stable ester features a methylated anthranilate core that enhances volatility and metabolic stability.
Application
Methyl 4-methylanthranilate serves as a versatile building block in synthetic organic chemistry, particularly for the construction of heterocyclic scaffolds and bioactive molecules. Its methyl ester functionality enables straightforward derivatization, while the ortho-aminobenzoate core offers reliable reactivity in coupling and cyclization processes. Bench-stable and amenable to purification via standard chromatographic methods, it functions effectively in both academic and industrial R&D workflows.
Synthesis
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Route1
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67-56-1 -
In-stock
2305-36-4 - ~89%
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In-stock
18595-17-0
References
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Painter, Thomas O.; Kaszas, Krisztian; Gross, Jacklyn; Douglas, Justin T.; Day, Victor W.; Iadarola, Michael J.; Santini, Conrad Bioorganic and Medicinal Chemistry Letters, 2014 , vol. 24, # 3 p. 963 - 968
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Route2
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In-stock
2305-36-4
- ~85%
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In-stock
18595-17-0
References
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Imperial Chemical Industries, PLC Patent: US5599814 A1, 1997 ;
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Route3
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186581-53-3
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In-stock
2305-36-4
- ~99%
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In-stock
18595-17-0
References
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Levesque, Patrick; Fournier, Pierre-Andre Journal of Organic Chemistry, 2010 , vol. 75, # 20 p. 7033 - 7036
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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-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 52.32
- LogP 1.36382
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 1
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