2-Boc-2-aza-spiro[3.3]hep...
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![2-Boc-2-aza-spiro[3.3]hep... structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d8fbe390baf04fd7b272bdb890cdb15f.png "2-Boc-2-aza-spiro[3.3]hep...")
2-Boc-2-aza-spiro[3.3]hep...
structure -
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CAS No:
1211526-53-2
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Formula:
C12H19NO4
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Chemical Name:
2-Boc-2-aza-spiro[3.3]hep...
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Synonyms:
2-Boc-2-aza-spiro[3.3]hep...;2-Boc-2-aza-spiro[3.3]heptane-6-carboxylic acid;2-Azaspiro[3.3]heptane-2,6-dicarboxylic acid 2-tert-butyl ester;2-(tert-Butoxycarbonyl)-2-azaspiro[3.3]heptane-6-carboxylic acid;6-tert-Butoxycarbonyl-6-azaspiro[3.3]heptane-2-carboxylic acid;2-Azaspiro[3.3]heptane-2,6-dicarboxylic acid 2-tert-butyl ester - A6137
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CAS No:
Characteristics
66.8
1
1.23±0.1 g/cm3(Predicted)
95-97 °C(Solv: ethanol (64-17-5))
377.4±42.0 °C(Predicted)
2-Boc-2-aza-spiro[3.3]hep... Use and Manufacturing
Compound 3 (2.0 g, 9.0 mmol) was dissolved in ethanol (40 mL) and water (40 mL)Potassium hydroxide (2.0 g, 36.0 mmol) was then added and stirred overnight at room temperature.TLC (petroleum ether / ethyl acetate volume ratio = 1/1, Rf = 0.0) indicated that the reaction was complete, then most of the ethanol was concentrated in vacuo, then the pH was adjusted to 3-4 with 1N hydrochloric acid and the aqueous phase extracted with dichloromethane The combined organics were dried over anhydrous sodium sulfate and concentrated in vacuo to dryness to give compound 4 (1.3 g) in 62percent yield.
Computed Properties
Molecular Weight:241.28
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:241.13140809
Monoisotopic Mass:241.13140809
Topological Polar Surface Area:66.8
Heavy Atom Count:17
Complexity:344
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
