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N,N-Dimethylisopropylamine

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Name

N,N-Dimethylisopropylamine

EINECS 213-635-5
CAS No. 996-35-0 Density 0.734 g/cm3
PSA 3.24000 LogP 0.95640
Solubility 100g/L at 25℃ Melting Point -115.88°C (estimate)
Formula C5H13N Boiling Point 65.8 °C at 760 mmHg
Molecular Weight 87.1649 Flash Point -9 °C
Transport Information UN 2733 Appearance Clear liquid
Safety 16-26-29-36/37/39-45-61 Risk Codes 11-34-51/53
Molecular Structure Molecular Structure of 996-35-0 (N,N-Dimethylisopropylamine) Hazard Symbols
Synonyms

Dimethylisopropylamine;

Article Data 25

N,N-Dimethylisopropylamine Synthetic route

124-40-3

dimethyl amine

67-64-1

acetone

996-35-0

N,N-dimethylisopropyl amine

Conditions
ConditionsYield
With hydrogen; ZrO2-containing catalyst at 80 - 170℃; under 150015 Torr;99%
With water; hydrogen; platinum at 25℃; under 2280 Torr; Ueberdruck;
917-64-6

methyl magnesium iodide

5350-67-4

α-(dimethylamino)-propionitrile

A

996-35-0

N,N-dimethylisopropyl amine

B

10524-60-4

3-(dimethylamino)-2-butanone

Conditions
ConditionsYield
With diethyl ether
reagiert analog mit Aethylmagnesiumbromid; mit Propylmagnesiumbromid und mit Cyclohexylmagnesiumchlorid nur die entspr.Ketone erhalten werden;
50-00-0

formaldehyd

15572-56-2

isopropylamine hydrochloride

996-35-0

N,N-dimethylisopropyl amine

Conditions
ConditionsYield
at 135℃;
4995-18-0

N,N,N-Trimethylisopropylammonium iodide

141-43-5

ethanolamine

A

996-35-0

N,N-dimethylisopropyl amine

B

75-50-3

trimethylamine

Conditions
ConditionsYield
at 154℃; Rate constant;
50-00-0

formaldehyd

75-31-0

isopropylamine

996-35-0

N,N-dimethylisopropyl amine

Conditions
ConditionsYield
With formic acid; water
With formic acid
With formic acid
917-64-6

methyl magnesium iodide

1783-25-1

N1,N1-dimethyl-N2-phenylformamidine

996-35-0

N,N-dimethylisopropyl amine

Conditions
ConditionsYield
(i) AcCl, (ii) /BRN= 1209226/; Multistep reaction;
110-18-9

N,N,N,N,-tetramethylethylenediamine

996-35-0

N,N-dimethylisopropyl amine

Conditions
ConditionsYield
With ethyllithium at 150℃;
10556-98-6

1,3,5-Triisopropyl-1,3,5-triazacyclohexane

91076-68-5

mono-trimethylsilylphosphite

A

996-35-0

N,N-dimethylisopropyl amine

B

4747-21-1

N-methylpropan-2-amine

126191-35-3

2-(tert-Butylazo)-2(dimethylamino)propane

A

996-35-0

N,N-dimethylisopropyl amine

B

75-28-5

Isobutane

C

22499-75-8

Acetone N,N-dimethylenamine

D

22752-64-3

2-Dimethylamino-4-methyl-pentadien-(1,3)

E

124-40-3

dimethyl amine

F

67-64-1

acetone

Conditions
ConditionsYield
In benzene-d6 Mechanism; Product distribution; Heating;
126191-35-3

2-(tert-Butylazo)-2(dimethylamino)propane

A

996-35-0

N,N-dimethylisopropyl amine

B

75-28-5

Isobutane

C

33050-99-6

acetone tert-butylhydrazone

D

13952-69-7

1,2-di-tert-butylhydrazine

E

124-40-3

dimethyl amine

F

67-64-1

acetone

Conditions
ConditionsYield
In [D3]acetonitrile Mechanism; Product distribution; Heating; solvent wet or dried;

N,N-Dimethylisopropylamine Specification

The N,N-Dimethylisopropylamine, with the CAS registry number of 996-35-0, is also known as Dimethylisopropylamine. It belongs to the product categories of Amines; C2 to C6; Nitrogen Compounds. Its EINECS registry number is 213-635-5. This chemical's molecular formula is C5H13N and molecular weight is 87.16. What's more, both its systematic name and IUPAC name are the same which is called N,N-Dimethylpropan-2-amine. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about the N,N-Dimethylisopropylamine are: (1)ACD/LogP: 0.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.14; (4)ACD/LogD (pH 7.4): -1.47; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.401; (14)Molar Refractivity: 28.89 cm3; (15)Molar Volume: 118.6 cm3; (16)Surface Tension: 21 dyne/cm; (17)Density: 0.734 g/cm3; (18)Enthalpy of Vaporization: 30.78 kJ/mol; (19)Boiling Point: 65.8 °C at 760 mmHg; (20)Vapour Pressure: 155 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce Isopropyl-methyl-pyrimidin-2-yl-amine and Dimethyl-pyrimidin-2-yl-amine. This reaction needs reagent 2-Chloro-pyrimidine and solvent Tetrahydrofuran. Other condition of this reaction is reaction time of 4 days at 100°C. The yield is about 90 %.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is highly flammable, toxic to aquatic organisms, and may cause long-term adverse effects in the aquatic environment. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. During using it, wear suitable protective clothing, gloves and eye/face protection. Besides, it may causes burns and you should avoid release it to the environment or empty into drains.

You can still convert the following datas into molecular structure: 
(1) SMILES:N(C(C)C)(C)C
(2) InChI:InChI=1/C5H13N/c1-5(2)6(3)4/h5H,1-4H3
(3) InChIKey:VMOWKUTXPNPTEN-UHFFFAOYAZ

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