(S)-tert-Butyl 3-aminopiperidine-1-carboxylate
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(S)-tert-Butyl 3-aminopiperidine-1-carboxylate
structure -
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CAS No:
625471-18-3
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Formula:
C10H20N2O2
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Chemical Name:
(S)-tert-Butyl 3-aminopiperidine-1-carboxylate
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Synonyms:
1-Piperidinecarboxylic acid,3-amino-,1,1-dimethylethyl ester,(3S)-;1,1-dimethylethyl (3S)-3-aminopiperidine-1-carboxylate;(S)-3-Amino-1-Boc-Piperidine;tert-Butyl (3S)-3-aminopiperidine-1-carboxylate;(S)-3-Aminopiperidine-1-carboxylic acid tert-butyl ester;(S)-tert-Butyl 3-aminopiperidine-1-carboxylate;(3S)-Aminopiperidine-1-carboxylic acid tert-butyl ester;(S)-1-tert-Butoxycarbonyl-3-aminopiperidine;3-Aminopiperidine-1-carboxylic acid (S)-tert-butyl ester;tert-Butyl (3S)-3-aminopiperidine-1-carboxylate;tert-Butyl (S)-3-aminopiperidine-1-carboxylate;1,1-Dimethylethyl (3S)-3-aminopiperidine-1-carboxylate;(S)-3-Amino-1-(tert-butoxycarbonyl)piperidine;(S)-1-Boc-3-aminopiperidine;(S)-(+)-1-Boc-3-aminopiperidine;(S)-tert-Butyl3-aminopiperidinecarboxylate
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CAS No:
(S)-tert-Butyl 3-aminopiperidine-1-carboxylate Basic Attributes
200.28
200.28
1312995-182-4
DTXSID50363571
2933399090
Characteristics
55.6
0.7
Colorless to yellow Gum or Semi-Solid
1.0±0.1 g/cm3
277.3°C at 760 mmHg
122℃
1.484
soluble in dimethylsulfoxide.
Storeunderinertgas
-28.5 º (c=1, DMF)
Safety Information
8
2735
3
22-36/37/38
26
Xn
P261-P305 + P351 + P338
H302-H315-H319-H335
|Danger|H302 (85.11%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
(S)-tert-Butyl 3-aminopiperidine-1-carboxylate Use and Manufacturing
Azido derivative 42a (6.77 g, 29.9 mmol) and Pd/C catalyst (150 mg) were hydrogenated in ethanol (200 ml) at an atmospheric pressure overnight. The catalyst was filtered through Celite and the solvent was evaporated. Product 43a was obtained in a 90percent yield (5.39 g, 26.9 mmol) as a colorless liquid without further purification.
Computed Properties
Molecular Weight:200.28
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:200.152477885
Monoisotopic Mass:200.152477885
Topological Polar Surface Area:55.6
Heavy Atom Count:14
Complexity:211
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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