ChemicalBook > CAS DataBase List > BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

Product Name: BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
CAS No.: 167757-45-1
Chemical Name: BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
Synonyms: BUTTPARK 75\50-02;N-Z-ISONIPECOTINAMIDE;Benzyl Benzoate Impurity 15;1-Cbz-4-piperidinecarboxamide;1-N-CBZ-PIPERIDINE-4-CARBOXAMIDE;Benzyl 4-carbamoyl-1-piperidinecarboxylate;Benzyl 4-(aminocarbonyl)-1-pyridinecarboxylate;Benzyl 4-(aminocarbonyl)piperidine-1-carboxylate;4-CARBAMOYL-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER;4-carbamoyl-2-piperidinecarboxylic acid (phenylmethyl) ester
CBNumber: CB4750950
Molecular Formula: C14H18N2O3
Formula Weight: 262.3
MOL File: 167757-45-1.mol

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BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE Property

Melting point:: 130 °C
Boiling point:: 475.5±44.0 °C(Predicted)
Density: 1.224±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 16.40±0.20(Predicted)
Appearance: White to off-white Solid
InChI: InChI=1S/C14H18N2O3/c15-13(17)12-6-8-16(9-7-12)14(18)19-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H2,15,17)
InChIKey: UNJWOPBEKPMSGH-UHFFFAOYSA-N
SMILES: N1(C(OCC2=CC=CC=C2)=O)CCC(C(N)=O)CC1

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Safety

Risk Statements: 36/37/38
Safety Statements: 26-36/37/39
HS Code: 2933399990

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H332Harmful if inhaled

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC

Product number: B225020
Product name: Benzyl4-(aminocarbonyl)tetrahydro-1(2h)-pyridinecarboxylate
Packaging: 100mg
Price: $45
Updated: 2021/12/16

ChemScene

Product number: CS-0037042
Product name: Benzyl4-carbamoylpiperidine-1-carboxylate
Packaging: 1g
Price: $51
Updated: 2021/12/16

Chem-Impex

Product number: 17207
Product name: N-Z-Isonipecotinamide,≥96%(HPLC)
Purity: ≥96%(HPLC)
Packaging: 1G
Price: $60.34
Updated: 2021/12/16

AK Scientific

Product number: W3649
Product name: Benzyl4-(aminocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate
Packaging: 1g
Price: $89
Updated: 2021/12/16

Biosynth Carbosynth

Product number: FB56341
Product name: Benzyl 4-(aminocarbonyl)tetrahydro-1(2H)pyridinecarboxylate
Packaging: 1g
Price: $90.8
Updated: 2021/12/16

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BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE Chemical Properties,Usage,Production

Synthesis

39546-32-2

1885-14-9

167757-45-1

Piperidine-4-carboxamide (5 g, 39 mmol) and benzyl chloroformate (5.54 mL, 39 mmol) were added dropwise to 1N NaOH solution (39 mL, 39 mmol) in a solvent mixture of water (30 mL) and acetone (40 mL), and the pH was maintained between 6 and 8 during the reaction. The reaction mixture was stirred at room temperature for 3 hours. Subsequently, the acetone was removed by evaporation, the resulting precipitate was collected by filtration and dried under reduced pressure at 70 °C to afford benzyl-4-carbamoylpiperidine-1-carboxylate 7.75 g in 76% yield. The product was analyzed by HPLC with a retention time (Rt) of 4.54 min. 1H NMR (600 MHz, DMSO-d6) δ ppm: 7.41-7.29 (m, 5H), 7.25 (br.s, 1H), 6.76 (br.s, 1H), 5.07 (s, 2H), 4.06-3.81 (m, J=13.2 Hz, 2H ), 2.92-2.72 (m, 2H), 2.27 (tt, J=3.7,11.5Hz, 1H), 1.75-1.64 (m, 2H), 1.40 (dq, J=4.3,12.4Hz, 2H). The high resolution mass spectrometry (HRMS) (ESI) [M+H]+ calculated value of C14H18O3N2 was 263.1390 and the measured value was 263.1390.

References

[1] Patent: US2013/324551, 2013, A1. Location in patent: Paragraph 0314; 0315; 0316; 0317
[2] Patent: US5607944, 1997, A

BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE Preparation Products And Raw materials

Raw materials

Preparation Products

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BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE Suppliers

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167757-45-1, BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATERelated Search:

Hexahydroisonicotinamide 1-Piperidinecarboxylic acid, 2-(aminocarbonyl)-, phenylmethyl ester 1-N-CBZ-NIPECOTAMIDE BUTTPARK 93\50-41 4-(4-TERT-BUTOXYCARBONYLAMINO-PIPERIDINE-1-CARBONYL)-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER BENZYL 4-([(2-CHLOROETHYL)AMINO]CARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE BENZYL 4-[(METHOXYAMINO)CARBONYL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE BUTTPARK 154\50-50 BUTTPARK 93\50-42 BENZYL 4-([(2-METHOXY-2-OXOETHYL)AMINO]CARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE 4-HYDRAZINOCARBONYL-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER BENZYL 4-(N-METHOXY-N-METHYLCARBAMOYL)PIPERIDINE-1-CARBOXYLATE BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

N-Z-ISONIPECOTINAMIDE

4-CARBAMOYL-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER

BUTTPARK 75\50-02

BENZYL 4-(AMINOCARBONYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

1-Piperidinecarboxylic acid, 4-(aminocarbonyl)-, phenylmethyl ester

Benzyl 4-(aminocarbonyl)piperidine-1-carboxylate

1-Cbz-4-piperidinecarboxamide

1-N-CBZ-PIPERIDINE-4-CARBOXAMIDE

Benzyl 4-(aminocarbonyl)-1-pyridinecarboxylate

Benzyl 4-carbamoyl-1-piperidinecarboxylate

4-carbamoyl-2-piperidinecarboxylic acid (phenylmethyl) ester

Benzyl Benzoate Impurity 15

167757-45-1