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699-04-7

699-04-7 Structure

699-04-7 Structure
IdentificationBack Directory
[Name]

N-Methyl-N-(4-methylbenzyl)amine
[CAS]

699-04-7
[Synonyms]

CHEMBRDG-BB 4004536
N-Methyl-N-(4-methyl
(4-Methylbenzyl)methylamine
4-Methyl-N-methylbenzylamine
N-Methyl-4-methylbenzylamine
4-[(Methylamino)methyl]toluene
N-Methyl-1-(p-tolyl)MethanaMine
N-METHYL-N-(4-METHYLBENZYL)AMINE
BenzeneMethanaMine, N,4-diMethyl-
N-methyl-1-(4-methylphenyl)methanamine
methyl-[(4-methylphenyl)methyl]ammonium
N-methyl-1-(4-methylphenyl)methanamine(SALTDATA: HCl)
[Molecular Formula]

C9H13N
[MDL Number]

MFCD04115412
[MOL File]

699-04-7.mol
[Molecular Weight]

135.21
Chemical PropertiesBack Directory
[Melting point ]

70°C
[Boiling point ]

70 ºC (1 MMHG)
[density ]

0.917±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[form ]

liquid
[pka]

9.98±0.10(Predicted)
[color ]

Colorless
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Corrosion (GHS05)
GHS07,GHS05
[Signal word ]

Danger
[Hazard statements ]

H314-H302+H312+H332
[Precautionary statements ]

P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
[Hazard Codes ]

C,Xi
[Risk Statements ]

22-34-36
[Safety Statements ]

36/37/39-26-23
[HS Code ]

2921490090
Spectrum DetailBack Directory
[Spectrum Detail]

N-Methyl-N-(4-methylbenzyl)amine(699-04-7)1HNMR
Hazard InformationBack Directory
[Synthesis]

4-Methylbenzyl chloride

104-82-5

Methylamine

74-89-5

N-Methyl-N-(4-methylbenzyl)amine

699-04-7

To a stirred solution of 4-methylbenzyl chloride (2.5 g, 17.85 mmol) in ethanol (15 ml) was slowly added 40% aqueous methylamine (5 ml) and stirred continuously for 4 h at room temperature. The reaction process was monitored by thin layer chromatography (TLC). Upon completion of the reaction, the reaction mixture was concentrated under reduced pressure to remove the solvent and subsequently quenched with deionized water (30 ml). The aqueous phase was extracted with dichloromethane (2 x 25 ml) and the organic phases were combined and dried with anhydrous sodium sulfate. The dried organic phase was concentrated under reduced pressure to afford N-methyl-N-(4-methylbenzyl)amine as a yellow oil (2.1 g, 87% yield).

[References]

[1] Patent: WO2009/109998, 2009, A1. Location in patent: Page/Page column 50
[2] Patent: WO2009/109999, 2009, A1. Location in patent: Page/Page column 70
[3] Journal of Medicinal Chemistry, 2013, vol. 56, # 20, p. 8073 - 8088
[4] Justus Liebigs Annalen der Chemie, 1931, vol. 490, p. 189,200
[5] Journal of Medicinal Chemistry, 1983, vol. 26, # 3, p. 309 - 312
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