1,3-dimethylamylamine
Conditions | Yield |
---|---|
With ethanol; sodium; toluene |
Conditions | Yield |
---|---|
Stage #1: 1,3-dimethylamylamine; chloroacetic acid With sodium hydrogencarbonate In water at 70℃; Stage #2: With hydrogenchloride In water for 168h; pH=2; | 96% |
Conditions | Yield |
---|---|
With benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine; dicyclohexyl-carbodiimide In dichloromethane at 20℃; | 62% |
Conditions | Yield |
---|---|
With Cu2Al3Ox-HT In toluene at 160℃; for 24h; Sealed tube; Inert atmosphere; | 21% |
Conditions | Yield |
---|---|
at 0℃; |
1,3-dimethylamylamine
chloroacetaldehyde diethyl acetal
(2,2-diethoxy-ethyl)-(1,3-dimethyl-pentyl)-amine
Conditions | Yield |
---|---|
at 120℃; |
(1,1-dimethyl-propylperoxy)-methanol
1,3-dimethylamylamine
2--4-methylhexan
hydroxymethyl tert-butyl peroxide
1,3-dimethylamylamine
2--4-methylhexan
1,3-dimethylamylamine
(1,1-dimethyl-butylperoxy)-methanol
2--4-methylhexan
Conditions | Yield |
---|---|
With triethylamine In diethyl ether |
1,3-dimethylamylamine
5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carbonyl chloride
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 20℃; for 2h; |
1,3-dimethylamylamine
3,7-dichloro-4H-1,2,4-benzothiadiazine 1,1-dioxide
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 0 - 20℃; |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: triethylamine / dichloromethane / 0 - 20 °C 2: phthaloyl peroxide; tetrabutyl-ammonium chloride / 1,2-dichloro-ethane / 12 h / 20 °C / Irradiation; Inert atmosphere; Schlenk technique View Scheme |
Conditions | Yield |
---|---|
With 5-nitro-2-hydroxypyridine; 1,1,1,3',3',3'-hexafluoro-propanol; 2-(2-methoxyphenyl)-2-oxoacetic acid; water; palladium diacetate; silver trifluoroacetate at 120℃; for 48h; Sealed tube; | n/a |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: dicyclohexyl-carbodiimide; benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine / dichloromethane / 20 °C 2: palladium(II) trimethylacetate; 4‐benzyloxy‐2‐hydroxy‐pyridine; silver carbonate; sodium 2,2,2-trifluoroacetate / tert-butyl methyl ether / 36 h / 130 °C View Scheme |
The CAS registry number of 1,3-Dimethylpentylamine is 105-41-9. In addition, the molecular formula is C7H17N and the molecular weight is 115.22. What's more, it is a vasoconstrictor, and can be administered by inhalation to the nasal mucosa to exert its effect. It is also a constituent of flower oil.
Physical properties about this chemical are: (1)ACD/LogP: 2.16; (2)ACD/LogD (pH 5.5): -0.94; (3)ACD/LogD (pH 7.4): -0.84; (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: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.424; (13)Molar Refractivity: 37.93 cm3; (14)Molar Volume: 148.5 cm3; (15)Polarizability: 15.03 ×10-24cm3; (16)Surface Tension: 25.7 dyne/cm; (17)Density: 0.775 g/cm3; (18)Flash Point: 28.9 °C; (19)Enthalpy of Vaporization: 37.14 kJ/mol; (20)Boiling Point: 133.9 °C at 760 mmHg; (21)Vapour Pressure: 8.29 mmHg at 25°C.
Preparation and uses of 1,3-Dimethylpentylamine: it may be synthesized by reacting 4-methylhexan-2-one with hydroxylammonium chloride to give the oxime, followed by reduction via sodium in ethanol. And it can be used as a nasal decongestant. Moreover, it is used in treatment for hypertrophied or hyperplasic oral tissues. In addition, it can be used as an OTC thermogenic or general purpose stimulant.
You can still convert the following datas into molecular structure:
(1)SMILES: NC(C)CC(C)CC
(2)InChI: InChI=1/C7H17N/c1-4-6(2)5-7(3)8/h6-7H,4-5,8H2,1-3H3
(3)InChIKey: YAHRDLICUYEDAU-UHFFFAOYAU
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 185mg/kg (185mg/kg) | "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989Vol. 11, Pg. 957, 1989. |
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