CAS Number15026-17-2
Synonyms4-(tert-Butoxy)-4-oxobutanoic acid; Butanedioic acid, mono(1,1-dimethylethyl) ester; mono-tert-Butyl succinate; 4-tert-Butoxy-4-oxobutanoic acid; 4-[(2-Methyl-2-propanyl)oxy]-4-oxobutanoic acid; 4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid; Succinic acid mono-tert-butyl ester; MFCD00273441
Molecular Formula(CH3)3OCO(CH2)2CO2H
Molecular Weight174.19
Purity97%
Density1.1±0.1 g/cm3
Boiling Point272.4±23.0 °C at 760 mmHg
Melting Point51-54 °C (lit.)
AppearanceSolid | Yellow-brown
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 15026-17-2 |
| Catalog No. | 2A-9036422 |
| Chinese Name | 单叔丁基琥珀酸酯 |
| Synonyms | 4-(tert-Butoxy)-4-oxobutanoic acid; Butanedioic acid, mono(1,1-dimethylethyl) ester; mono-tert-Butyl succinate; 4-tert-Butoxy-4-oxobutanoic acid; 4-[(2-Methyl-2-propanyl)oxy]-4-oxobutanoic acid; 4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid; Succinic acid mono-tert-butyl ester; MFCD00273441 |
| Molecular Formula | (CH3)3OCO(CH2)2CO2H |
| Molecular Weight | 174.19 |
| Purity | 97 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 272.4±23.0 °C at 760 mmHg |
| Melting Point | 51-54 °C (lit.) |
| Appearance | Solid | Yellow-brown |
| Water Solubility | Slightly soluble in water. |
| Storage Condition | Store in a cool place. Keep container tightly clos |
| HTC | 2918990090 |
| PubChem ID | 24878932 |
| MDL Number | MFCD00273441 |
| SMILES | CC(C)(C)OC(=O)CCC(O)=O |
| InChI | 1S/C8H14O4/c1-8(2,3)12-7(11)5-4-6(9)10/h4-5H2,1-3H3,(H,9,10) |
| InChI Key | PCOCFIOYWNCGBM-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/36422_1_15026_17_2.pdf |
| Use of | health and chemical hazard data given on this sheet. Storage:Store in closed vessels, refrigerated. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point:No data Flash point:No data Molecular formula: C8H14O4 Molecular weight: 174.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information Signal Word Warning Hazard Statements H315-H319-H335 Precautionary Statements P261-P305 + P351 + P338 Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves Hazard Codes Xi:Irritant; Safety Phrases S26-S36 RIDADR NONH for all modes of transport WGK Germany 3 HS Code 2918990090 Synthetic Route 1-O-benzyl 4-O-... CAS#:15026-16-1 Succinic acid m... CAS#:15026-17-2 Literature: Nelson, Michael E.; Priestley, Nigel D. Journal of the American Chemical Society, 2002 , vol. 124, # 12 p. 2894 - 2902 Methyl 2-methyl... CAS#:14734-25-9 Succinic acid m... CAS#:15026-17-2 Literature: Salomon, Claudio J.; Mata, Ernesto G.; Mascaretti, Oreste A. Journal of Organic Chemistry, 1994 , vol. 59, # 24 p. 7259 - 7266 Succinic anhydride CAS#:108-30-5 tert-Butanol CAS#:75-65-0 Succinic acid m... CAS#:15026-17-2 Literature: Colombo, Raffaele; Mingozzi, Michele; Belvisi, Laura; Arosio, Daniela; Piarulli, Umberto; Carenini, Nives; Perego, Paola; Zaffaroni, Nadia; De Cesare, Michelandrea; Castiglioni, Vittoria; Scanziani, Eugenio; Gennari, Cesare Journal of Medicinal Chemistry, 2012 , vol. 55, # 23 p. 10460 - 10474 Precursor & DownStream Precursor 10 CAS#:15026-16-1 1-O-benzyl 4-O-... CAS#:14734-25-9 Methyl 2-methyl... CAS#:108-30-5 Succinic anhydride CAS#:75-65-0 tert-Butanol DownStream 6 CAS#:432037-43-9 tert-Butyl chlo... CAS#:59854-12-5 tert-Butyl 4-hy... CAS#:1663-39-4 tert-Butyl acrylate CAS#:51534-77-1 2-Methyl-2-prop... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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