CAS No.188111-79-7,(R)-1-Boc-3-Aminopiperidine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	188111-79-7
Name:	(R)-1-Boc-3-Aminopiperidine
Article Data:	5
Cas Database

Formula:	C₁₀H₂₀N₂O₂
Molecular Weight:	200.281
Synonyms:	(R)-1-BOC-3-Aminopiperidine;(R)-3-Amino-1-N-BOC-piperidine;(R)-1-Boc-3-aminopiperidine;(R)-(-)-3-Amino-1-Boc-piperidine;tert-butyl (3R)3-aminopiperidine-1-carboxylate;(R)-3-aminopiperidine-1-carboxylic acid tert-butyl ester;(R)-(-)-1-Boc-3-aminopiperidine;(R)-tert-Butyl 3-aminopiperidine-1-carboxylate;(R)-tert-butyl 3-aminopiperidine-1-carboxylate;
EINECS:	628-472-9
Density:	1.041g/cm3
Boiling Point:	277.3 °C at 760 mmHg
Flash Point:	121.5 °C
Solubility:	Immiscible with water.
Hazard Symbols:	Xn
Risk Codes:	22-36/37/38
Safety:	26
Transport Information:	UN 2735
PSA:	55.56000
LogP:	1.98280

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Synthetic route

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tert-butyl (3R)-3-{[(benzyloxy)carbonyl]amino}piperidine-1-carboxylate

: 188111-79-7
tert-butyl (3R)3-aminopiperidine-1-carboxylate

Conditions

Conditions	Yield
Pd-C In methanol	99%

: C10H18N2O2

: 188111-79-7
tert-butyl (3R)3-aminopiperidine-1-carboxylate

Conditions

Conditions	Yield
With bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; C13H18FeP2; hydrogen; sodium hydride In dichloromethane Large scale;	95.2%

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(R)-tert-butyl 3-carbamoylpiperidine-1-carboxylate

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

Conditions

Conditions	Yield
With sodium hypochlorite; sodium hydroxide In water at 15 - 25℃; for 16h;	80%

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3-oxo-piperidine-1-carboxylic acid tert-butyl ester

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

Conditions

Conditions	Yield
With pyridoxal 5'-phosphate; immobilized Codex® amine ω-transaminase; isopropylamine In dimethyl sulfoxide at 50℃; pH=7.5; Temperature; Enzymatic reaction; enantioselective reaction;	70%
Multi-step reaction with 2 steps 1: ammonium acetate / ethanol / 7 h / Reflux; Large scale 2: bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; sodium hydride; C13H18FeP2; hydrogen / dichloromethane / Large scale View Scheme

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

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6-methylimidazo<2,1-b>thiazole-5-carboxylic acid

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(R)-3-[(6-methyl-imidazo[2,1-b]thiazole-5-carbonyl)-amino]-piperidine-1-carboxylic acid tert-butyl ester

Conditions

Conditions	Yield
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 20h;	100%
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 20h;	100%

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

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3,5-dichloro-pyrazine-2-carbonitrile

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tert-butyl (3R)-3-[(6-chloro-5-cyanopyrazin-2-yl)amino]piperidine-1-carboxylate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 1h;	100%
With N-ethyl-N,N-diisopropylamine In butan-1-ol at 20 - 50℃;	60%

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

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3-(4-chloro-5-nitropyrimidin-2-yl)-6-fluoroimidazo[1,2-a]pyridine

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(R)-tert-butyl 3-(2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-nitropyrimidin-4-ylamino)piperidine-1-carboxylate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In tetrahydrofuran at 20℃;	100%

: 188111-79-7
tert-butyl (3R)3-aminopiperidine-1-carboxylate

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2-chloroethyl isothiocyanate

: tert-butyl (3R)-3-{[(2-chloroethyl)carbamoyl]amino}piperidine-1-carboxylate

Conditions

Conditions	Yield
With triethylamine In dichloromethane for 4.41667h;	100%
With triethylamine In 4-(dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran at 20℃; for 4h;	81.5%

: 188111-79-7
tert-butyl (3R)3-aminopiperidine-1-carboxylate

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4-methoxybenzoic acid

: (R)-tert-butyl 3-(4-methoxybenzamido)piperidine-1-carboxylate

Conditions

Conditions	Yield
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In 1,4-dioxane; N,N-dimethyl-formamide at 20℃; for 3h;	100%

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tert-butyl (3R)3-aminopiperidine-1-carboxylate

: 3-(4,6-dichloro-5-fluoropyrimidin-2-yl)pyrazolo[1,5-a]pyridine

: tert-butyl (3R)-3-[(6-chloro-5-fluoro-2-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-4-yl)amino]piperidine-1-carboxylate

Conditions

Conditions	Yield
With triethylamine In ethanol at 80℃; for 48h;	100%
With triethylamine In ethanol at 80℃; for 48h;	100%

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Specification

The (R)-1-Boc-3-aminopiperidine, with the CAS registry number 188111-79-7, is also known as (R)-3-Amino-1-N-Boc-piperidine. It belongs to the product categories of Aminoacid; Pharmacetical; Piperidine; Piperidine Series; Piperidines; Chiral Chemicals. This chemical's molecular formula is C₁₀H₂₀N₂O₂ and molecular weight is 200.278. Its IUPAC name is called tert-butyl (3R)-3-aminopiperidine-1-carboxylate.

Physical properties of (R)-1-Boc-3-aminopiperidine: (1)ACD/LogP: 0.71; (2)ACD/LogD (pH 5.5): -2.35; (3)ACD/LogD (pH 7.4): -1.53; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.483; (12)Molar Refractivity: 54.99 cm³; (13)Molar Volume: 192.2 cm³; (14)Surface Tension: 37.8 dyne/cm; (15)Density: 1.041 g/cm³; (16)Flash Point: 121.5 °C; (17)Enthalpy of Vaporization: 51.59 kJ/mol; (18)Boiling Point: 277.3 °C at 760 mmHg; (19)Vapour Pressure: 0.00456 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful if swallowed. In addition, it is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)N1CCCC(C1)N
(2)Isomeric SMILES: CC(C)(C)OC(=O)N1CCC[C@H](C1)N
(3)InChI: InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(11)7-12/h8H,4-7,11H2,1-3H3/t8-/m1/s1
(4)InChIKey: AKQXKEBCONUWCL-MRVPVSSYSA-N