tert-Butyl acetate
tert-Butyl acetate structure
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Common Name | tert-Butyl acetate | ||
|---|---|---|---|---|
| CAS Number | 540-88-5 | Molecular Weight | 116.158 | |
| Density | 0.862 | Boiling Point | 98 ºC | |
| Molecular Formula | C6H12O2 | Melting Point | -62°C | |
| MSDS | Chinese USA | Flash Point | 15 ºC | |
| Symbol |
GHS02 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | tert-Butyl acetate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.862 |
|---|---|
| Boiling Point | 98 ºC |
| Melting Point | -62°C |
| Molecular Formula | C6H12O2 |
| Molecular Weight | 116.158 |
| Flash Point | 15 ºC |
| Exact Mass | 116.083733 |
| PSA | 26.30000 |
| LogP | 1.40 |
| Vapour Pressure | 40.6±0.2 mmHg at 25°C |
| Index of Refraction | 1.385-1.387 |
| InChIKey | WMOVHXAZOJBABW-UHFFFAOYSA-N |
| SMILES | CC(=O)OC(C)(C)C |
| Water Solubility | insoluble |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS02 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H225 |
| Supplemental HS | Repeated exposure may cause skin dryness or cracking. |
| Precautionary Statements | P210 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | F:Flammable |
| Risk Phrases | R11;R66 |
| Safety Phrases | S16-S23-S25-S29-S33 |
| RIDADR | UN 1123 3/PG 2 |
| WGK Germany | 1 |
| RTECS | AF7400000 |
| Packaging Group | III |
| Hazard Class | 3 |
| HS Code | 2915390090 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 9 | |
CAS#:75-36-5
CAS#:75-65-0
CAS#:75-97-8
CAS#:108-24-7
CAS#:372-19-0
CAS#:5292-43-3
CAS#:64-19-7
CAS#:115-11-7
CAS#:1118-32-7
CAS#:104847-07-6
CAS#:32677-01-3
CAS#:562-90-3
CAS#:32864-38-3
CAS#:344-62-7
CAS#:5545-52-8
CAS#:42417-76-5![tert-Butyl (E)-7-[3'-(4''-fluorophenyl)-1'-methylethyl-indol-2'-yl]-3-hydroxy-5-oxo-6-heptenoate structure](https://image.chemsrc.com/caspic/132/375846-25-6.png)
CAS#:375846-25-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2915390090 |
|---|---|
| Summary | 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Syntheses of stereochemically restricted lactone-type analogues of jasmonic acids.
Biosci. Biotechnol. Biochem. 64(9) , 1988-92, (2000) 5-Oxa-7-epi-jasmonic acid and 5-oxa-jasmonic acid, which are stereochemically restricted lactone-type analogues of jasmonic acids, were synthesized via three-component coupling of 2(5H)-furanone, tert... |
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DOT1L inhibitor EPZ-5676 displays synergistic antiproliferative activity in combination with standard of care drugs and hypomethylating agents in MLL-rearranged leukemia cells.
J. Pharmacol. Exp. Ther. 350(3) , 646-56, (2014) EPZ-5676 [(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-((((1r,3S)-3-(2-(5-(tert-butyl)-1H-benzo[d]imidazol-2-yl)ethyl)cyclobutyl)(isopropyl)amino)methyl)tetrahydrofuran-3,4-diol], a small-molecule inhibi... |
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Amphiphilic hyperbranched fluoropolymers as nanoscopic 19F magnetic resonance imaging agent assemblies.
Biomacromolecules 9(10) , 2826-33, (2008) Three hyperbranched fluoropolymers were synthesized and their micelles were constructed as potential (19)F MRI agents. A hyperbranched star-like core was first synthesized via atom transfer radical se... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| tert-butyl N-acetate |
| 1,1-Dimethyl acetate |
| Acetic Acid tert-Butyl Ester |
| tert-Butylacetate |
| tert-Butyl ethanoate |
| anhydrous tert-butyl acetate |
| EINECS 208-760-7 |
| tert-BuOCOCH3 |
| MFCD00008807 |
| tert.-Butyl acetate |
| 2-Methyl-2-propanyl acetate |
| Acetic acid,1,1-dimethylethyl ester |
| t-Butyl acetate |
| Texaco lead appreciator |
| 1,1-dimethylethyl acetate |
| Acetic acid, 1,1-dimethylethyl ester |
| Tert-buty acetate |
| tert-Butyl acetate |
| tert-Butylacetat |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the melting point of tert-Butyl acetate? |
| A: Melting point of tert-Butyl acetate is -62°C. |
| Q: What is the polar surface area (PSA) of tert-Butyl acetate? |
| A: Polar surface area (PSA) of tert-Butyl acetate is 26.30000. |
| Q: What is the LogP of tert-Butyl acetate? |
| A: LogP of tert-Butyl acetate is 1.40. |
| Q: What is the safety information for tert-Butyl acetate? |
| A: Safety information for tert-Butyl acetate: S16-S23-S25-S29-S33. |
| Q: How is the water solubility of tert-Butyl acetate? |
| A: Water solubility of tert-Butyl acetate: insoluble. |
| Q: What is the CAS number of tert-Butyl acetate? |
| A: CAS number of tert-Butyl acetate is 540-88-5. |
| Q: What is the English name of tert-Butyl acetate? |
| A: The English name of tert-Butyl acetate is tert-Butyl acetate. |
| Q: What are the downstream products of tert-Butyl acetate? |
| A: Related downstream products(CAS) of tert-Butyl acetate: 1118-32-7;104847-07-6;32677-01-3;562-90-3;32864-38-3;344-62-7;5545-52-8;42417-76-5;375846-25-6. |
| Q: What is the boiling point of tert-Butyl acetate? |
| A: Boiling point of tert-Butyl acetate is 98 ºC. |
| Q: What is the molecular formula of tert-Butyl acetate? |
| A: Molecular formula of tert-Butyl acetate is C6H12O2. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |