Lot numbers can be found on the outside label of a product:
Methyl 3-bromo-5-(hydroxymethyl)benzoate
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CAS No. 307353-32-8
- Cat. No. CS-B1348
- Purity≥96%
- MDL No.MFCD11040228
*For research and further manufacturing use only, not for direct human use.
Structure of 307353-32-8
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General Information
- CAS No. 307353-32-8
- Cat. No. CS-B1348
- Purity ≥96%
- MDL No. MFCD11040228
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₉BrO₃
- Molecular Weight 245.07
- Synonym(s) Benzoic acid, 3-bromo-5-(hydroxymethyl)-, methyl ester
- SMILES BrC1=CC(C(OC)=O)=CC(CO)=C1
Description
Methyl 3-bromo-5-(hydroxymethyl)benzoate features a brominated aromatic ring paired with a pendant hydroxymethyl group, enabling versatile functionalization. This bench-stable derivative integrates readily into cross-coupling and derivatization workflows, offering selective reactivity at the halogen site while maintaining compatibility with diverse reaction conditions.
Application
Methyl 3-bromo-5-(hydroxymethyl)benzoate serves as a versatile building block for the synthesis of substituted benzoic acid derivatives and heterocyclic scaffolds. The bromo group enables palladium-catalyzed cross-coupling reactions, while the hydroxymethyl functionality offers a handle for oxidation, protection, or further functionalization. Its bench-stable nature and compatibility with standard synthetic protocols make it well-suited for iterative medicinal chemistry campaigns and process development.
Synthesis
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References
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TEIJIN LIMITED Patent: EP1460059 A1, 2004 ; Location in patent: Page 8 ;
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Route2
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220286-47-5 - ~60%
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In-stock
307353-32-8
References
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Bristol-Myers Squibb Company Patent: US2007/249607 A1, 2007 ; Location in patent: Page/Page column 85 ; US 20070249607 A1
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Route3
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In-stock
51760-21-5 - ~99%
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In-stock
307353-32-8
References
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TEIJIN LIMITED Patent: EP1179527 A1, 2002 ; Location in patent: Page 20 ;
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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 46.53
- LogP 1.728
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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