Lot numbers can be found on the outside label of a product:
Isopropyl methoxyacetate
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CAS No. 17640-21-0
- Cat. No. CS-M1127
- Purity≥95%
- MDL No.MFCD16038497
*For research and further manufacturing use only, not for direct human use.
Structure of 17640-21-0
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General Information
- CAS No. 17640-21-0
- Cat. No. CS-M1127
- Purity ≥95%
- MDL No. MFCD16038497
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₆H₁₂O₃
- Molecular Weight 132.16
- Synonym(s) Isopropyl 2-methoxyacetate
- SMILES O=C(COC)OC(C)C
Description
Isopropyl methoxyacetate is a bench-stable, moisture-tolerant ester featuring a methoxyacetyl moiety that enables efficient incorporation into synthetic sequences. This compound delivers enhanced solubility in organic solvents and serves as a selective protecting group for carboxylic acids during multi-step synthesis.
Application
Isopropyl methoxyacetate serves as a stable, bench-ready building block for the synthesis of bioactive molecules and heterocyclic scaffolds. Its ester functionality enables straightforward hydrolysis to yield methoxyacetic acid, while the isopropyl group provides steric protection and ease of purification. The molecule exhibits good functional group tolerance and compatibility with standard coupling and reduction protocols, facilitating its use in iterative synthetic sequences for pharmaceutical intermediates and agrochemicals.
Synthesis
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Route1
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67-63-0 -
In-stock
625-45-6 - ~96%
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In-stock
17640-21-0
References
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BASF Aktiengesellschaft Patent: US6720447 B1, 2004 ; Location in patent: Page column 11-12 ;
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Route2
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96-34-4
- ~74%
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In-stock
17640-21-0
References
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Huels Aktiengesellschaft Patent: US6143920 A1, 2000 ;
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Route3
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In-stock
38870-89-2 -
67-63-0
- ~%
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In-stock
17640-21-0
References
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Van Waes, Frederik E. A.; Cukalovic, A.; Stevens, Christian V.; Drabowicz, J. Green Chemistry, 2012 , vol. 14, # 10 p. 2776 - 2779,4
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS02,GHS07
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Signal Word : Danger
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UN#: 1993
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Class : 3
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Packing Group : Ⅲ
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Hazard Statements : H225-H315-H319-H335
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Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 35.53
- LogP 0.5844
- H_Acceptors 3
- H_Donors 0
- Rotatable_Bonds 3
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