Methyl 5-(bromomethyl)-2-thiophenecarboxylate
Methyl 5-(bromomethyl)-2-thiophenecarboxylate structure
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Common Name | Methyl 5-(bromomethyl)-2-thiophenecarboxylate | ||
|---|---|---|---|---|
| CAS Number | 108499-32-7 | Molecular Weight | 235.098 | |
| Density | 1.6±0.1 g/cm3 | Boiling Point | 300.6±32.0 °C at 760 mmHg | |
| Molecular Formula | C7H7BrO2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 135.6±25.1 °C | |
Summary: Methyl 5-(bromomethyl)thiophene-2-carboxylate (Chinese name: 5-(溴甲基)-2-噻吩羧酸甲酯，CAS number: 108499-32-7，molecular formula: C7H7BrO2S，molecular weight: 235.098)，for research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Methyl 5-(bromomethyl)thiophene-2-carboxylate |
|---|---|
| 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 | 1.6±0.1 g/cm3 |
|---|---|
| Boiling Point | 300.6±32.0 °C at 760 mmHg |
| Molecular Formula | C7H7BrO2S |
| Molecular Weight | 235.098 |
| Flash Point | 135.6±25.1 °C |
| Exact Mass | 233.934998 |
| PSA | 54.54000 |
| LogP | 2.50 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.585 |
| InChIKey | GFOPHLFSDVVYGB-UHFFFAOYSA-N |
| SMILES | COC(=O)c1ccc(CBr)s1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xn |
|---|---|
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
Methyl 5-(bromo... CAS#:108499-32-7 |
| Literature: ELI LILLY AND COMPANY; HAMDOUCHI, Chafiq Patent: WO2013/25424 A1, 2013 ; Location in patent: Page/Page column 8 ; |
|
~94%
Methyl 5-(bromo... CAS#:108499-32-7 |
| Literature: ALLERGAN, INC. Patent: US2009/247527 A1, 2009 ; Location in patent: Page/Page column 24 ; |
|
~%
Methyl 5-(bromo... CAS#:108499-32-7 |
| Literature: SRI International Patent: US5354751 A1, 1994 ; |
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~%
Methyl 5-(bromo... CAS#:108499-32-7
Learn More
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| Literature: Choong, Ingrid C.; Lew, Willard; Lee, Dennis; Pham, Phuongly; Burdett, Matthew T.; Lam, Joni W.; Wiesmann, Christian; Luong, Tinh N.; Fahr, Bruce; DeLano, Warren L.; McDowell, Robert S.; Allen, Darin A.; Erlanson, Daniel A.; Gordon, Eric M.; O'Brien, Tom Journal of Medicinal Chemistry, 2002 , vol. 45, # 23 p. 5005 - 5022 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
CAS#:75985-18-1![5-[[(4-chlorobenzoyl)amino]methyl]thiophene-2-carboxylic acid structure](https://image.chemsrc.com/caspic/144/830331-52-7.png)
CAS#:830331-52-7This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-Bromomethyl-2-carbomethoxythiophene |
| 5-bromomethylthiophene-2-carboxylic acid methyl ester |
| 2-methoxycarbonyl-5-bromomethyl-thiophene |
| 2-Thiophenecarboxylic acid, 5-(bromomethyl)-, methyl ester |
| Methyl pound inverted question mark5-(bromomethyl)-2-thiophenecarboxylate |
| Methyl 5-(bromomethyl)-2-thiophenecarboxylate |
| 5-bromomehtylthiophene-2-carboxylic acid methyl ester |
| methyl 5-bromomethylthiophene-2-carboxylate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Polar surface area (PSA) of Methyl 5-(bromomethyl)thiophene-2-carboxylate is 54.54000. |
| Q: What is the boiling point of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Boiling point of Methyl 5-(bromomethyl)thiophene-2-carboxylate is 300.6±32.0 °C at 760 mmHg. |
| Q: What is the LogP of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: LogP of Methyl 5-(bromomethyl)thiophene-2-carboxylate is 2.50. |
| Q: What are the upstream materials of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Related upstream materials(CAS) of Methyl 5-(bromomethyl)thiophene-2-carboxylate: 19432-69-0;530145-16-5;1918-79-2. |
| Q: What is the CAS number of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: CAS number of Methyl 5-(bromomethyl)thiophene-2-carboxylate is 108499-32-7. |
| Q: What is the molecular weight of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Molecular weight of Methyl 5-(bromomethyl)thiophene-2-carboxylate is 235.098. |
| Q: What are the downstream products of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Related downstream products(CAS) of Methyl 5-(bromomethyl)thiophene-2-carboxylate: 75985-18-1;830331-52-7. |
| Q: What is the English name of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: The English name of Methyl 5-(bromomethyl)thiophene-2-carboxylate is Methyl 5-(bromomethyl)thiophene-2-carboxylate. |
| Q: What is the SMILES notation of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: SMILES notation of Methyl 5-(bromomethyl)thiophene-2-carboxylate is COC(=O)c1ccc(CBr)s1. |
| Q: What is the molecular formula of Methyl 5-(bromomethyl)thiophene-2-carboxylate? |
| A: Molecular formula of Methyl 5-(bromomethyl)thiophene-2-carboxylate is C7H7BrO2S. |
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. |