29976-53-2

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29976-53-2 Structure

Identification	More
[Name] N-Carbethoxy-4-piperidone
[CAS] 29976-53-2
[Synonyms] 1-CARBETHOXY-4-PIPERIDONE 1-ETHOXYCARBONYL-4-PIPERIDONE 1-PIPERIDINECARBOXYLIC ACID, 4-OXO-, ETHYL ESTER 4-OXO-PIPERIDINE-1-CARBOXYLIC ACID ETHYL ESTER 4-PIPERIDONE-1-CARBOXYLIC ACID ETHYL ESTER 4-PIPERIDONE-N-CARBOXYLIC ACID ETHYL ESTER AURORA KA-3057 ETHYL 4-OXO-1-PIPERIDINECARBOXYLATE ETHYL 4-OXOPIPERIDINE-1-CARBOXYLATE ETHYL 4-PIPERIDONE-1-CARBOXYLATE ETHYL 4-PIPERIDONE-N-CARBOXYLATE N-CARBETHOXY-4-PIPERIDONE N-CARBOETHOXY-4-PIPERIDONE N-ETHOXYCARBONYL-4-PIPERIDONE 4-Oxo-1-piperidinecarboxylic acid ethyl ester N-Carbithoxy-4-Piperidone 1-Ethoxycarbonyl-4-Piperidone N-Carbethoxy-4-Hydroxy Piperidine N-Carbethoxypiperidone 1-ETHOXYCARBONYL-4-PIPERIDONE 97+% N-Carbethoxy-4-Piperidone99%
[EINECS(EC#)] 249-984-5
[Molecular Formula] C8H13NO3
[MDL Number] MFCD00006188
[Molecular Weight] 171.19
[MOL File] 29976-53-2.mol

Chemical Properties	Back Directory
[Appearance] clear colorless to pale yellow colored liquid
[Boiling point ] 95-98 °C (1 mmHg)
[density ] 1.135 g/mL at 25 °C(lit.)
[vapor pressure ] 0.2-0.37Pa at 20-25℃
[refractive index ] n20/D 1.475(lit.)
[Fp ] 190 °F
[storage temp. ] Inert atmosphere,Room Temperature
[solubility ] Chloroform (Slightly), Methanol (Slightly)
[form ] Liquid
[pka] -1.59±0.20(Predicted)
[color ] Clear colorless to pale yellow
[PH] 4.6 (H2O, 20℃)(saturated solution)
[Water Solubility ] slightly soluble
[BRN ] 640967
[InChIKey] LUBGFMZTGFXIIN-UHFFFAOYSA-N
[LogP] 0 at 20℃ and pH6.5-6.7
[CAS DataBase Reference] 29976-53-2(CAS DataBase Reference)

Safety Data	Back Directory
[Hazard Codes ] Xn,Xi
[Risk Statements ] R36/38:Irritating to eyes and skin . R22:Harmful if swallowed. R36/37/38:Irritating to eyes, respiratory system and skin . R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ] S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) . S24/25:Avoid contact with skin and eyes . S37/39:Wear suitable gloves and eye/face protection . S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36:Wear suitable protective clothing .
[WGK Germany ] 3
[Hazard Note ] Irritant
[HazardClass ] IRRITANT
[HS Code ] 29333999

Raw materials And Preparation Products	Back Directory
[Raw materials] Penfluridol
[Preparation Products] 4-(2-KETO-1-BENZIMIDAZOLINYL)PIPERIDINE-->N-phenylpiperidin-4-amine-->4-(4-FLUORO-PHENYL)-PIPERIDIN-4-OL HYDROCHLORIDE-->Ethyl 4-amino-1-piperidinecarboxylate-->AKOS USSH-4110751-->1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-4-methoxy-, ethyl ester-->ethyl 4-hydroxy-4-(2-(2-hydroxyethyl)phenyl)piperidine-1-carboxylate-->1-Piperidinecarboxylicacid,4-amino-4-cyano-,ethylester(9CI)-->ETHYL 2-AMINO-3-CARBAMOYL-4,7-DIHYDRO-5H-THIENO[2,3-C]-PYRIDINE-6-CARBOXYLATE-->ethyl (3S,4R)-4-amino-3-methoxypiperidine-1-carboxylate-->ethyl 4-(2,3-difluoro-6-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)-4-hydroxypiperidine-1-carboxylate-->Ethyl 4-hydroxypiperidine-1-carboxylate

Material Safety Data Sheet(MSDS)	Back Directory
[msds information] N-Carbethoxy-4-piperidone(29976-53-2).msds

Hazard Information	Back Directory
[Chemical Properties] clear colorless to pale yellow colored liquid
[Uses] N-Carbethoxy-4-piperidone is used in the preparation of 3-hydrazinopyridazines as antihypertensive agents as well as γ-carboline derivatives as potential serotonergic agents. N-Carbethoxy-4-piperidone is also an Impurity of Loratadine (L469575).

Spectrum Detail	Back Directory
[Spectrum Detail] N-Carbethoxy-4-piperidone(29976-53-2)MS N-Carbethoxy-4-piperidone(29976-53-2)¹HNMR N-Carbethoxy-4-piperidone(29976-53-2)¹³CNMR N-Carbethoxy-4-piperidone(29976-53-2)IR1 N-Carbethoxy-4-piperidone(29976-53-2)Raman

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