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tert-Butyl hydrogen malonate, 96%
CAS: 40052-13-9 | C7H12O4 | 160.169 g/mol
$107.33 - $398.96
Chemical Identifiers
| CAS | 40052-13-9 |
|---|---|
| Molecular Formula | C7H12O4 |
| Molecular Weight (g/mol) | 160.169 |
| MDL Number | MFCD00191886 |
| InChI Key | NGGGZUAEOKRHMA-UHFFFAOYSA-N |
| Synonym | 3-tert-butoxy-3-oxopropanoic acid, malonic acid mono-tert-butyl ester, mono-tert-butyl malonate, 2-tert-butoxycarbonyl acetic acid, tert-butyl hydrogen malonate, mono-t-butyl malonate, pubchem13754, malonicacidmono-tert-butylester, malonic acid mono t-butyl ester |
| PubChem CID | 545853 |
| IUPAC Name | 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid |
| SMILES | CC(C)(C)OC(=O)CC(=O)O |
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
|---|---|---|---|---|---|---|---|---|---|
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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AAH2622306
|
Thermo Scientific Chemicals
H2622306 |
5 g |
Each for $107.33
|
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AAH2622314
|
Thermo Scientific Chemicals
H2622314 |
25 g |
Each for $398.96
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Description
tert-Butyl hydrogen malonate may be used in the preparation of dendritic precursor to asymmetric methanofullerenes, hapten-3,6-(O,S-dimethylthiophosphoramido)-6-oxohexanoic acid, hapten-4,3-(O,S-dimethylthiophosphoramido)-3-oxopropanoic acid.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
Applicationstert-Butyl hydrogen malonate may be used in the preparation of dendritic precursor to asymmetric methanofullerenes, hapten-3,6-(O,S-dimethylthiophosphoramido)-6-oxohexanoic acid, hapten-4,3-(O,S-dimethylthiophosphoramido)-3-oxopropanoic acid.
Solubility
Soluble in ethanol.
Notes
Store in a cool, dry condition in a well sealed container.
Chemical Identifiers
| 40052-13-9 | |
| 160.169 | |
| NGGGZUAEOKRHMA-UHFFFAOYSA-N | |
| 545853 | |
| CC(C)(C)OC(=O)CC(=O)O |
| C7H12O4 | |
| MFCD00191886 | |
| 3-tert-butoxy-3-oxopropanoic acid, malonic acid mono-tert-butyl ester, mono-tert-butyl malonate, 2-tert-butoxycarbonyl acetic acid, tert-butyl hydrogen malonate, mono-t-butyl malonate, pubchem13754, malonicacidmono-tert-butylester, malonic acid mono t-butyl ester | |
| 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid |
Specifications
| 40052-13-9 | |
| 1.04 | |
| 91°C (195°F) | |
| 1.426 | |
| 5 g | |
| 3-tert-butoxy-3-oxopropanoic acid, malonic acid mono-tert-butyl ester, mono-tert-butyl malonate, 2-tert-butoxycarbonyl acetic acid, tert-butyl hydrogen malonate, mono-t-butyl malonate, pubchem13754, malonicacidmono-tert-butylester, malonic acid mono t-butyl ester | |
| NGGGZUAEOKRHMA-UHFFFAOYSA-N | |
| 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid | |
| 545853 | |
| 96% |
| 19°C to 20°C | |
| 90°C (2 mmHg) | |
| C7H12O4 | |
| MFCD00191886 | |
| 1765457 | |
| Soluble in ethanol. | |
| CC(C)(C)OC(=O)CC(=O)O | |
| 160.169 | |
| 160.17 | |
| tert-Butyl hydrogen malonate |
Safety and Handling
GHS H Statement
H315-H319-H335
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
P210-P235-P260-P264b-P271-P280-P284-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378q-P501c
H227-H314-H330-H335
DOTInformation : Hazard Class: 8; Packaging Group: III
TSCA : No
Recommended Storage : Ambient temperatures
RUO – Research Use Only