CAS Number1694-31-1
SynonymsAcetoacetic acid tert-butyl ester; 2-Methyl-2-propanyl 3-oxobutanoate; Acetoacetic acid, tert-butyl ester; MFCD00008811; tert-Butyl 3-oxobutyrate; tert-Butyl acetoacetate; tert-butyl 3-oxobutanoate; Butanoic acid, 3-oxo-, 1,1-dimethylethyl ester; T-BUTYL 3-OXOBUTANOATE; EINECS 216-904-5; t-Butyl acetoacetate
Molecular FormulaCH3COCH2COOC(CH3)3
Molecular Weight158.19
Purity95%
Density1.0±0.1 g/cm3
Boiling Point71-72 °C/11 mmHg (lit.)
Melting Point-38 °C (lit.)
AppearanceTransparent yellow liquid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1694-31-1 |
| Catalog No. | 2A-9027300 |
| Chinese Name | 乙酰乙酸叔丁酯 |
| Synonyms | Acetoacetic acid tert-butyl ester; 2-Methyl-2-propanyl 3-oxobutanoate; Acetoacetic acid, tert-butyl ester; MFCD00008811; tert-Butyl 3-oxobutyrate; tert-Butyl acetoacetate; tert-butyl 3-oxobutanoate; Butanoic acid, 3-oxo-, 1,1-dimethylethyl ester; T-BUTYL 3-OXOBUTANOATE; EINECS 216-904-5; t-Butyl acetoacetate |
| Molecular Formula | CH3COCH2COOC(CH3)3 |
| Molecular Weight | 158.19 |
| Purity | 95 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 71-72 °C/11 mmHg (lit.) |
| Melting Point | -38 °C (lit.) |
| Appearance | Transparent yellow liquid |
| Water Solubility | Water solubility: slightly soluble |
| Storage Condition | Stable under normal temperature and pressure, avoi |
| Packaging | III |
| HTC | 2918300090 |
| PubChem ID | 24878235 |
| MDL Number | MFCD00008811 |
| SMILES | CC(=O)CC(=O)OC(C)(C)C |
| InChI | 1S/C8H14O3/c1-6(9)5-7(10)11-8(2,3)4/h5H2,1-4H3 |
| InChI Key | JKUYRAMKJLMYLO-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1680303 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 3.2 |
| MSDS | msds/27300_1_1694_31_1.pdf |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 95.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
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