tert-Butyl 2-bromobenzoate
tert-Butyl 2-bromobenzoate structure
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Common Name | tert-Butyl 2-bromobenzoate | ||
|---|---|---|---|---|
| CAS Number | 55666-42-7 | Molecular Weight | 257.12400 | |
| Density | 1.331 g/cm3 | Boiling Point | 280.3ºC at 760 mmHg | |
| Molecular Formula | C11H13BrO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 123.3ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | tert-Butyl 2-bromobenzoate |
|---|---|
| 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 | 1.331 g/cm3 |
|---|---|
| Boiling Point | 280.3ºC at 760 mmHg |
| Molecular Formula | C11H13BrO2 |
| Molecular Weight | 257.12400 |
| Flash Point | 123.3ºC |
| Exact Mass | 256.01000 |
| PSA | 26.30000 |
| LogP | 3.40440 |
| InChIKey | ZELNHJFYEDOWLF-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)c1ccccc1Br |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916399090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~57%
tert-Butyl 2-br... CAS#:55666-42-7 |
| Literature: Wrigglesworth, Joe W.; Cox, Brian; Lloyd-Jones, Guy C.; Booker-Milburn, Kevin I. Organic Letters, 2011 , vol. 13, # 19 p. 5326 - 5329 |
|
~63%
tert-Butyl 2-br... CAS#:55666-42-7 |
| Literature: RIPKA, Amy S.; SAUNDERS, Jeffrey O.; KAMENECKA, Theodore Mark; GRIFFIN, Patrick R. Patent: WO2013/78237 A1, 2013 ; Location in patent: Page/Page column 77 ; |
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~%
tert-Butyl 2-br... CAS#:55666-42-7 |
| Literature: Bulletin de la Societe Chimique de France, , p. 2985 - 2986 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| tert-butyl o-bromobenzoate |
| 2-bromo-tert-butylbenzoate |
| 1,1-Dimethylethyl 2-bromobenzoate |
| AB3324 |
| 2-BROMO-BENZOIC ACID TERT-BUTYL ESTER |
| 2-bromo-benzoic acid t-butyl ester |
| tert-butyl 2-bromobezoate |
| TERT-BUTYL-2-BROMOBENZOATE |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of tert-Butyl 2-bromobenzoate? |
| A: CAS number of tert-Butyl 2-bromobenzoate is 55666-42-7. |
| Q: What is the English name of tert-Butyl 2-bromobenzoate? |
| A: The English name of tert-Butyl 2-bromobenzoate is tert-Butyl 2-bromobenzoate. |
| Q: What is the InChIKey of tert-Butyl 2-bromobenzoate? |
| A: InChIKey of tert-Butyl 2-bromobenzoate is ZELNHJFYEDOWLF-UHFFFAOYSA-N. |
| Q: What is the molecular formula of tert-Butyl 2-bromobenzoate? |
| A: Molecular formula of tert-Butyl 2-bromobenzoate is C11H13BrO2. |
| Q: What is the SMILES notation of tert-Butyl 2-bromobenzoate? |
| A: SMILES notation of tert-Butyl 2-bromobenzoate is CC(C)(C)OC(=O)c1ccccc1Br. |
| Q: What is the molecular weight of tert-Butyl 2-bromobenzoate? |
| A: Molecular weight of tert-Butyl 2-bromobenzoate is 257.12400. |
| Q: What is the polar surface area (PSA) of tert-Butyl 2-bromobenzoate? |
| A: Polar surface area (PSA) of tert-Butyl 2-bromobenzoate is 26.30000. |
| Q: What is the LogP of tert-Butyl 2-bromobenzoate? |
| A: LogP of tert-Butyl 2-bromobenzoate is 3.40440. |
| Q: What is the boiling point of tert-Butyl 2-bromobenzoate? |
| A: Boiling point of tert-Butyl 2-bromobenzoate is 280.3ºC at 760 mmHg. |
| Q: What English synonyms does tert-Butyl 2-bromobenzoate have? |
| A: English synonyms of tert-Butyl 2-bromobenzoate: tert-butyl o-bromobenzoate, 2-bromo-tert-butylbenzoate, 1,1-Dimethylethyl 2-bromobenzoate, AB3324, 2-BROMO-BENZOIC ACID TERT-BUTYL ESTER, 2-bromo-benzoic acid t-butyl ester, tert-butyl 2-bromobezoate, TERT-BUTYL-2-BROMOBENZOATE. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |