CAS Number542-08-5
SynonymsButanoic acid, 3-oxo-, 1-methylethyl ester; EINECS 208-798-4; isopropyl acetoacetate; propan-2-yl 3-oxobutanoate; MFCD00043933; Isopropyl 3-oxobutanoate
Molecular FormulaCH3COCH2COOCH(CH3)2
Molecular Weight144.17
Purity≥99.0 (GC)%
Density1.0±0.1 g/cm3
Boiling Point95 °C/52 hPa (lit.)
Melting Point-27°C
Appearanceliquid
EINECS208-798-4
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 542-08-5 |
| Catalog No. | 2A-9014693 |
| Chinese Name | 乙酰乙酸异丙酯 |
| Synonyms | Butanoic acid, 3-oxo-, 1-methylethyl ester; EINECS 208-798-4; isopropyl acetoacetate; propan-2-yl 3-oxobutanoate; MFCD00043933; Isopropyl 3-oxobutanoate |
| Molecular Formula | CH3COCH2COOCH(CH3)2 |
| Molecular Weight | 144.17 |
| Purity | ≥99.0 (GC) |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 95 °C/52 hPa (lit.) |
| Melting Point | -27°C |
| Appearance | liquid |
| Storage Condition | Store in a cool, dry, well-ventilated warehouse. K |
| EINECS | 208-798-4 |
| HTC | 2918300090 |
| PubChem ID | 329761217 |
| MDL Number | MFCD00043933 |
| SMILES | CC(C)OC(=O)CC(C)=O |
| InChI | 1S/C7H12O3/c1-5(2)10-7(9)4-6(3)8/h5H,4H2,1-3H3 |
| InChI Key | GVIIRWAJDFKJMJ-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1757046 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| MSDS | msds/14693_1_542_08_5.pdf |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| 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 United Nations shipping name 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 Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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