Mono-tert-butyl Malonate
Mono-tert-butyl Malonate (CAS 40052-13-9) supplier Zemixal: C7H12O4, COA and SDS with every lot, worldwide shipping. Catalogue no. ZX-041303.
About Mono-tert-butyl Malonate
Mono-tert-butyl Malonate sits in our carboxylic Acids & Salts section and ships worldwide from stock or short lead time. Key data: CAS 40052-13-9, formula C7H12O4 and molar mass 160.17 g/mol.
Use cases we see most often
- Organic synthesis
- API synthesis
Handling and storage
Hazard communication follows GHS (Danger: H314, H315, H319 and H330). Our SDS lists exposure controls and first-aid measures.
Standard pack sizes are 100 mg, 250 mg, 1 g and 5 g, and custom quantities are quoted on request. Every shipment includes a batch certificate of analysis and a 16-section SDS. Request pricing online and we confirm availability, documentation and freight to your country.
Typical uses
- Organic synthesis
- API synthesis
Applications
Specifications and identifiers
| Product name | Mono-tert-butyl Malonate |
|---|---|
| Catalogue number | ZX-041303 |
| CAS number | 40052-13-9 |
| IUPAC name | 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid |
| Molecular formula | C7H12O4 |
| Molar mass | 160.17 g/mol |
| Exact mass | 160.0736 |
| XLogP3 | 0.8 |
| H-bond donors / acceptors | 1 / 4 |
| Topological polar surface area | 63.6 Ų |
| InChIKey | NGGGZUAEOKRHMA-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)CC(=O)O |
| PubChem CID | 545853 |
| Synonyms | 3-(tert-Butoxy)-3-oxopropanoic acid, 3-tert-Butoxy-3-oxopropanoic acid, Malonic acid mono-tert-butyl ester, mono-t-butyl malonate, 2-(tert-butoxycarbonyl)acetic acid, Propanedioic acid, mono(1,1-dimethylethyl) ester, 3-tert-butoxy-3-oxo-propanoic acid, malonic acid mono t-butyl ester, 3-tert-Butoxy-3-oxopropanoicacid, Malonic acid tert-butyl monoester, 3-tert-Butoxy-3-oxopropionic acid, 2-(tert-butoxy-carbonyl)acetic acid |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
Signal word Danger
- H314Causes severe skin burns and eye damage
- H315Causes skin irritation
- H319Causes serious eye irritation
- H330Fatal if inhaled
- H335May cause respiratory irritation
Precautionary statements P260, P261, P264, P264 + P265, P271, P280, P284, P301 + P330 + P331, P302 + P352, P302 + P361 + P354, P304 + P340, P305 + P351 + P338, P305 + P354 + P338, P316, P319, P320, P321, P332 + P317, P337 + P317, P362 + P364, P363, P403 + P233, P405, P501
Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.
Pack sizes
| 100 mg | Quoted on request | |
| 250 mg | Quoted on request | |
| 1 g | Quoted on request | |
| 5 g | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
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