S-2--Bromo-4-methylvaleric acid
S-2--Bromo-4-methylvaleric acid structure
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Common Name | S-2--Bromo-4-methylvaleric acid | ||
|---|---|---|---|---|
| CAS Number | 28659-87-2 | Molecular Weight | 195.05400 | |
| Density | 1.432g/cm3 | Boiling Point | 240.5ºC at 760 mmHg | |
| Molecular Formula | C6H11BrO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 99.3ºC | |
Summary: S-2--Bromo-4-methylvaleric acid (S-2-溴-4-甲基戊酸) is a compound with the Chinese name S-2-溴-4-甲基戊酸 and the CAS number 28659-87-2. Its molecular formula is C6H11BrO2 and molecular weight is 195.05400. The boiling point of this compound is 240.5ºC. 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 | S-2--Bromo -4-methylvaleric acid |
|---|---|
| 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 | 1.432g/cm3 |
|---|---|
| Boiling Point | 240.5ºC at 760 mmHg |
| Molecular Formula | C6H11BrO2 |
| Molecular Weight | 195.05400 |
| Flash Point | 99.3ºC |
| Exact Mass | 193.99400 |
| PSA | 37.30000 |
| LogP | 1.88060 |
| Vapour Pressure | 0.0126mmHg at 25°C |
| Index of Refraction | 1.485 |
| InChIKey | NNFDHJQLIFECSR-YFKPBYRVSA-N |
| SMILES | CC(C)CC(Br)C(=O)O |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2915900090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Pharmacia and Upjohn S.p.A. Patent: US6194451 B1, 2001 ; US 6194451 B1 |
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Otsuka Pharmaceutical Co., Ltd. Patent: US5594006 A1, 1997 ; US 5594006 A |
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Nicolaides, E. D.; Tinney, F. J.; Kaltenbronn, J. S.; Repine, J. T.; DeJohn, D. A.; et al. Journal of Medicinal Chemistry, 1986 , vol. 29, # 6 p. 959 - 971 |
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Kortylewicz; Galardy Journal of Medicinal Chemistry, 1990 , vol. 33, # 1 p. 263 - 273 |
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Kortylewicz; Galardy Journal of Medicinal Chemistry, 1990 , vol. 33, # 1 p. 263 - 273 |
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~%
S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Kortylewicz; Galardy Journal of Medicinal Chemistry, 1990 , vol. 33, # 1 p. 263 - 273 |
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S-2--Bromo-4-me... CAS#:28659-87-2 |
| Literature: Fischer,E. Chemische Berichte, 1906 , vol. 39, p. 2930 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 7 | |
CAS#:100869-07-6
CAS#:122999-39-7
CAS#:210345-89-4
CAS#:647025-21-6
CAS#:60335-50-4
CAS#:61837-46-5
CAS#:5344-20-7This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2915900090 |
|---|---|
| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-bromo-4-methyl-pentanoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of S-2--Bromo -4-methylvaleric acid? |
| A: SMILES notation of S-2--Bromo -4-methylvaleric acid is CC(C)CC(Br)C(=O)O. |
| Q: What English synonyms does S-2--Bromo -4-methylvaleric acid have? |
| A: English synonyms of S-2--Bromo -4-methylvaleric acid: 2-bromo-4-methyl-pentanoic acid. |
| Q: What is the molecular weight of S-2--Bromo -4-methylvaleric acid? |
| A: Molecular weight of S-2--Bromo -4-methylvaleric acid is 195.05400. |
| Q: What are the downstream products of S-2--Bromo -4-methylvaleric acid? |
| A: Related downstream products(CAS) of S-2--Bromo -4-methylvaleric acid: 100869-07-6;122999-39-7;210345-89-4;647025-21-6;60335-50-4;61837-46-5;5344-20-7. |
| Q: What is the LogP of S-2--Bromo -4-methylvaleric acid? |
| A: LogP of S-2--Bromo -4-methylvaleric acid is 1.88060. |
| Q: What is the CAS number of S-2--Bromo -4-methylvaleric acid? |
| A: CAS number of S-2--Bromo -4-methylvaleric acid is 28659-87-2. |
| Q: What is the molecular formula of S-2--Bromo -4-methylvaleric acid? |
| A: Molecular formula of S-2--Bromo -4-methylvaleric acid is C6H11BrO2. |
| Q: What is the boiling point of S-2--Bromo -4-methylvaleric acid? |
| A: Boiling point of S-2--Bromo -4-methylvaleric acid is 240.5ºC at 760 mmHg. |
| Q: What is the English name of S-2--Bromo -4-methylvaleric acid? |
| A: The English name of S-2--Bromo -4-methylvaleric acid is S-2--Bromo -4-methylvaleric acid. |
| Q: What are the upstream materials of S-2--Bromo -4-methylvaleric acid? |
| A: Related upstream materials(CAS) of S-2--Bromo -4-methylvaleric acid: 61-90-5;328-38-1;328-39-2;10203-58-4;4361-06-2;646-07-1;5338-45-4. |
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. |