ChemicalBook--->CAS DataBase List--->41838-46-4

41838-46-4

41838-46-4 Structure

41838-46-4 Structure
IdentificationMore
[Name]

1-Methylpiperidin-4-amine
[CAS]

41838-46-4
[Synonyms]

1-(5-BROMOPYRIMIDIN-2-YL)[1,4]DIAZEPANE
4-Amino-1-methylpiperdine
1-Methyl-4-Amino Piperidine
4-AMINO-1-METHYLPIPERDINE, 98.5%
1-Methylpiperidin-4-amine
4-Amino-1-methylpiperidine
N-Methyl-4-aminopiperidine
[EINECS(EC#)]

628-217-1
[Molecular Formula]

C6H14N2
[MDL Number]

MFCD03426069
[Molecular Weight]

114.19
[MOL File]

41838-46-4.mol
Chemical PropertiesBack Directory
[Melting point ]

203-207
[Boiling point ]

62-64°C 1mm
[density ]

0.91
[refractive index ]

1.4700-1.4740
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[form ]

clear liquid
[pka]

9.92±0.20(Predicted)
[color ]

Colorless to Light orange to Yellow
[Detection Methods]

GC
[InChI]

InChI=1S/C6H14N2/c1-8-4-2-6(7)3-5-8/h6H,2-5,7H2,1H3
[InChIKey]

ALOCUZOKRULSAA-UHFFFAOYSA-N
[SMILES]

N1(C)CCC(N)CC1
[CAS DataBase Reference]

41838-46-4(CAS DataBase Reference)
[Storage Precautions]

Store under nitrogen
Questions And AnswerBack Directory
[Uses]

4-Amino-1-methylpiperidine is used as an organic reagent and pharmaceutical intermediate.
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Corrosion (GHS05)
GHS02,GHS05
[Signal word ]

Danger
[Hazard statements ]

H226-H314
[Precautionary statements ]

P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

2920
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[PackingGroup ]

[HS Code ]

29333990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Methanol-->Thionyl chloride-->Bromine-->Potassium hydroxide-->Ammonium hydroxide-->Formaldehyde-->Formic acid-->Isonipecotic acid-->1-Methyl-4-piperidone-->Benzeneacetamide, 4-chloro-N-[(4-methylphenyl)methyl]-N-4-piperidinyl-
[Preparation Products]

TAK-960-->1-Methyl-N-(4-nitrophenyl)piperidin-4-amine-->SURECN6875931-->Benzamide, 4-iodo-N-(1-methyl-4-piperidinyl)--->3-methoxy-N-(1-methylpiperidin-4-yl)-4-nitrobenzamide
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless to yellow liquid
[Synthesis]

Benzeneacetamide, 4-chloro-N-[(4-methylphenyl)methyl]-N-4-piperidinyl-

359878-09-4

1-Methylpiperidin-4-amine

41838-46-4

N-((4-methoxyphenyl)methyl)-4-amino-1-methylpiperidine (1 g, 4.27 mmol) was used as starting material, which was dissolved in a methanol solution of 4% formic acid (60 mL). Under argon protection, 10% Pd/C (1 g) was added to the reaction system and the reaction mixture was subsequently heated to reflux for 24 hours. Upon completion of the reaction, the mixture was filtered through diatomaceous earth and the filtrate was acidified with concentrated hydrochloric acid to a pH of about 1. The resulting solution was concentrated to give a yellow oily substance. The oily substance was purified by fast chromatography (eluent: methanol/dichloromethane = 3:7 with 3.5% ammonia) to give 249 mg (51% yield) of 4-amino-1-methylpiperidine (57-MBT36B) as a white solid. Thin layer chromatography (TLC) Rf value was 0.13 (unfolding agent: 10% dichloromethane solution in methanol with 3.5% ammonia). High performance liquid chromatography-mass spectrometry (HPLC-MS, Method B) showed the molecular ion peak MH+ = 115. ultraviolet/mass spectrometry (UV/MS) detection showed a percent purity of -/100.

[References]

[1] Patent: WO2007/124136, 2007, A1. Location in patent: Page/Page column 126-127
Spectrum DetailBack Directory
[Spectrum Detail]

1-Methylpiperidin-4-amine(41838-46-4)1HNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

4-Amino-1-methylpiperidine,>97.0%(GC)(T)(41838-46-4)
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