CAS Number5396-89-4
SynonymsBenzyl 3-oxobutyrate; FEMA 2136; Benzylacetoacetat; BENZYL2-OXOBUTANOATE; Benzyl 3-oxobutanoate; Acetoacetic Acid Benzyl Ester; EINECS 226-416-4; Benzyl acetylacetate; Benzyl β-ketobutyrate; Acetoacetic acid, benzyl ester; Butanoic acid, 3-oxo-, phenylmethyl ester; benzyloxycarbonylacetone; AC-BENZYL; Benzyl acetoacetate; phenylmethyl 3-oxobutanoate; MFCD00008785; Benzyl3-oxobutanoate
Molecular FormulaCH3COCH2COOCH2C6H5
Molecular Weight192.21
Purity97%
Density1.1±0.1 g/cm3
Boiling Point156-159 °C/10 mmHg (lit.)
AppearanceTransparent colorless to yellow liquid
EINECS226-416-4
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 5396-89-4 |
| Catalog No. | 2A-9079719 |
| Chinese Name | 乙酰丙酮苄酯 |
| Synonyms | Benzyl 3-oxobutyrate; FEMA 2136; Benzylacetoacetat; BENZYL2-OXOBUTANOATE; Benzyl 3-oxobutanoate; Acetoacetic Acid Benzyl Ester; EINECS 226-416-4; Benzyl acetylacetate; Benzyl β-ketobutyrate; Acetoacetic acid, benzyl ester; Butanoic acid, 3-oxo-, phenylmethyl ester; benzyloxycarbonylacetone; AC-BENZYL; Benzyl acetoacetate; phenylmethyl 3-oxobutanoate; MFCD00008785; Benzyl3-oxobutanoate |
| Molecular Formula | CH3COCH2COOCH2C6H5 |
| Molecular Weight | 192.21 |
| Purity | 97 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 156-159 °C/10 mmHg (lit.) |
| Appearance | Transparent colorless to yellow liquid |
| Storage Condition | Avoid light, keep in a cool and dry place, sealed |
| EINECS | 226-416-4 |
| HTC | 2918300090 |
| PubChem ID | 24857819 |
| MDL Number | MFCD00008785 |
| SMILES | CC(=O)CC(=O)OCc1ccccc1 |
| InChI | 1S/C11H12O3/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 |
| InChI Key | WOFAGNLBCJWEOE-UHFFFAOYSA-N |
| Beilstein/REAXYS | 2049615 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/79719_1_5396_89_4.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 |
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