| CAS: | 4224-70-8 |
| MF: | C6H11BrO2 |
| MW: | 195.05 |
| EINECS: | 224-176-5 |
| Product Categories: | C6;Carbonyl Compounds;omega-Functional Alkanols, Carboxylic Acids, Amines & Halides;Carboxylic Acids;Chemical Synthesis;Organic Building Blocks;Organic acids;Acids & Esters;Bromine Compounds;omega-Bromocarboxylic Acids;Aliphatics;Miscellaneous Reagents;Building Blocks |
| Mol File: | 4224-70-8.mol |
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| 6-Bromohexanoic acid Chemical Properties |
| Melting point | 32-34 °C (lit.) |
| Boiling point | 165-170 °C/20 mmHg (lit.) |
| density | 1.3996 (rough estimate) |
| refractive index | 1.4790 (estimate) |
| Fp | 154 °F |
| storage temp. | Inert atmosphere,2-8°C |
| solubility | methanol: 0.1 g/mL, clear, colorless |
| pka | 4.72±0.10(Predicted) |
| form | Low Melting Crystals |
| color | White to light orange |
| BRN | 1749740 |
| InChIKey | NVRVNSHHLPQGCU-UHFFFAOYSA-N |
| LogP | 1.700 (est) |
| CAS DataBase Reference | 4224-70-8(CAS DataBase Reference) |
| NIST Chemistry Reference | Hexanoic acid, 6-bromo-(4224-70-8) |
| EPA Substance Registry System | Hexanoic acid, 6-bromo- (4224-70-8) |
| 6-Bromohexanoic acid Usage And Synthesis |
| Organic Intermediate | 6-bromohexanoic acid(CAS:4224-70-8), also called 6-bromohexanoic acid or 6-bromo-hexanoic acid, is an organobromine compound comprising hexanoic acid having a bromo substituent at the 6-position. 6-Bromohexanoic acid is used in the preparation of N-acylsulfonamides, diarylthioethers and 2-lithio-1,3-dithian. It is widely used as an intermediate in organic synthesis. Here, we introduced a method for making this compound. |
| Chemical Properties | White to light orange low melting crystals |
| Uses | Employed in a direct preparation of N-acylsulfonamides on treatment with tosyl isocyanate (189278)1 and alkyl ketones from alkyl iodides and metallic strontium.2 |
| Uses | 6-Bromohexanoic acid is used in the preparation of N-acylsulfonamides, diarylthioethers and 2-lithio-1,3-dithian. It is widely used as an intermediate in organic synthesis. |
| Uses | 6-Bromohexanoic acid was used in the preparation of N-acylsulfonamides on treatment with tosyl isocyanate (189278) and alkyl ketones from alkyl iodides and metallic strontium. It was also used in the synthesis of anionic mitomycin C-dextran conjugate (MMC-D), 2-lithio-1,3-dithian and diaryl thioethers. |
| Definition | ChEBI: 6-bromohexanoic acid is an organobromine compound comprising hexanoic acid having a bromo substituent at the 6-position. It is functionally related to a hexanoic acid. |
| Synthesis Reference(s) | Journal of the American Chemical Society, 72, p. 5137, 1950 DOI: 10.1021/ja01167a091 |
| Synthesis | The preparation method of the high purity 6-bromocaproic acid: the exsiccant bromize hydrogen gas is directly fed contain in the organic solvent of 6-caprolactone, exsiccant bromize hydrogen gas usage quantity is 6-caprolactone 1.0-2.0 doubly (mol ratio); Stir, ring-opening reaction takes place, temperature of reaction is 0 ℃ ~ 100 ℃, generates high purity 6-bromocaproic acid. |
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Lead Time :
| Quantity(Kilograms) | 1 - 10000 | >10000 |
| Est. Time(days) | 5 | To be negotiated |
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