Name: N,N,N'-TRIMETHYL-1,3-PROPANEDIAMINE
SKU: 4543-96-8

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Basic Information

Molecular Structure:
CAS No.:	4543-96-8
Name:	N,N,N'-TRIMETHYL-1,3-PROPANEDIAMINE
Article Data:	13

Formula:	C₆H₁₆N₂
Molecular Weight:	116.206
Synonyms:	1,3-Propanediamine,N,N,N'-trimethyl- (6CI,7CI,8CI,9CI);(3-Dimethylaminopropyl)methylamine;3-(Dimethylamino)-N-methylpropylamine;Methyl[3-(dimethylamino)propyl]amine;N,N,N'-Trimethyl-1,3-diaminopropane;N,N,N'-Trimethyl-1,3-propanediamine;N,N,N'-Trimethyltrimethylenediamine;N-(3-Dimethylaminopropyl)-N-methylamine;N-(3-Dimethylaminopropyl)methylamine;
EINECS:	224-901-5
Density:	0.808 g/cm³
Melting Point:	-7.15°C (estimate)
Boiling Point:	139.2 °C at 760 mmHg
Flash Point:	34.4 °C
Solubility:	Soluble in water.
Appearance:	clear colourless liquid
Hazard Symbols:	C
Risk Codes:	10-20/21/22-34
Safety:	16-26-36/37/39-45
PSA:	15.27000
LogP:	0.54840

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Specification

The N,N,N'-Trimethyl-1,3-propanediamine is an organic compound with the formula C₆H₁₆N₂. The systematic name of this chemical is N,N,N'-trimethylpropane-1,3-diamine. With the CAS registry number 4543-96-8, it is also named as 3-Dimethylamino-N-methylpropylamine. The product's categories are Nitrogen Compounds; Organic Building Blocks; Polyamines. Besides, it is clear colourless liquid, which should be stored in a dark cool and dry place.

Physical properties about N,N,N'-Trimethyl-1,3-propanediamine are: (1)ACD/LogP: -0.06; (2)ACD/LogD (pH 5.5): -4.16; (3)ACD/LogD (pH 7.4): -3.94; (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: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 6.48 Å²; (12)Index of Refraction: 1.43; (13)Molar Refractivity: 37.16 cm³; (14)Molar Volume: 143.6 cm³; (15)Polarizability: 14.73×10^-24cm³; (16)Surface Tension: 26 dyne/cm; (17)Density: 0.808 g/cm³; (18)Flash Point: 34.4 °C; (19)Enthalpy of Vaporization: 37.65 kJ/mol; (20)Boiling Point: 139.2 °C at 760 mmHg; (21)Vapour Pressure: 6.48 mmHg at 25°C.

Uses of N,N,N'-Trimethyl-1,3-propanediamine: it can be used to produce N-but-3-enyl-N,N',N'-trimethyl-propane-1,3-diamine at ambient temperature. It will need reagent diethyl ether with reaction time of 3 days. The yield is about 100%.

When you are using this chemical, please be cautious about it as the following:
It is flammable and harmful by inhalation, in contact with skin and if swallowed. Plaese keep away from sources of ignition - No smoking. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical can cause burns. When you are using it, wear suitable gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: N(C)CCCN(C)C
(2)InChI: InChI=1/C6H16N2/c1-7-5-4-6-8(2)3/h7H,4-6H2,1-3H3
(3)InChIKey: SORARJZLMNRBAQ-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C6H16N2/c1-7-5-4-6-8(2)3/h7H,4-6H2,1-3H3
(5)Std. InChIKey: SORARJZLMNRBAQ-UHFFFAOYSA-N