CAS No.4013-94-9,N,N'-Diisopropylethylenediamine Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	4013-94-9
Name:	N,N'-Diisopropylethylenediamine
Article Data:	17

Formula:	C₈H₂₀N₂
Molecular Weight:	144.26
Synonyms:	1,2-Ethanediamine,N,N'-bis(1-methylethyl)- (9CI);Ethylenediamine, N,N'-diisopropyl-(6CI,7CI,8CI);1,2-Bis(isopropylamino)ethane;N,N'-Diisopropyl-1,2-diaminoethane;N,N'-Diisopropylethylenediamine;
EINECS:	223-666-6
Density:	0.806 g/cm³
Melting Point:	52°C (estimate)
Boiling Point:	169.999 °C at 760 mmHg
Flash Point:	50.23 °C
Solubility:	Miscible with water.
Appearance:	clear colorless liquid
Hazard Symbols:	C
Risk Codes:	10-34
Safety:	16-26-27-36/37/39-45-25
Transport Information:	UN 2733 3/PG 3
PSA:	24.06000
LogP:	1.76420

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Specification

The N,N'-Diisopropylethylenediamine, with the CAS registry number 4013-94-9, is also known as 1,2-Bis(isopropylamino)ethane. It belongs to the product categories of Amine Monomers; Monomers; Secondary Amines. Its EINECS number is 223-666-6. This chemical's molecular formula is C₈H₂₀N₂ and molecular weight is 144.26. What's more, its systematic name is N,N'-Diisopropyl-1,2-ethanediamine. This chemical is stable at common pressure and temperature, and it should be sealed and stored in a ventilated and dry place. Moreover, it should be protected from light.

Physical properties of N,N'-Diisopropylethylenediamine are: (1)ACD/LogP: 1.108; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.77; (4)ACD/LogD (pH 7.4): -1.74; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 24.06 Å²; (13)Index of Refraction: 1.43; (14)Molar Refractivity: 46.219 cm³; (15)Molar Volume: 178.975 cm³; (16)Polarizability: 18.323×10^-24cm³; (17)Surface Tension: 25.2 dyne/cm; (18)Density: 0.806 g/cm³; (19)Flash Point: 50.23 °C; (20)Enthalpy of Vaporization: 40.641 kJ/mol; (21)Boiling Point: 169.999 °C at 760 mmHg; (22)Vapour Pressure: 1.5 mmHg at 25°C.

Preparation of N,N'-Diisopropylethylenediamine: this chemical can be prepared by N,N'-Bis-isopropylethylendiimin. This reaction will need reagent H₂ and solvent ethanol with the reaction time of 3 hours. This reaction will also need catalyst 10percent Pd/C. The yield is about 73%.

N,N'-Diisopropylethylenediamine can be prepared by N,N'-Bis-isopropylethylendiimin

Uses of N,N'-Diisopropylethylenediamine: it can be used to produce 1,4-diisopropyl-piperazin-2-one by heating. It will need solvent H₂O with the reaction time of 1 hour. The yield is about 58%.

N,N'-Diisopropylethylenediamine can be used to produce 1,4-diisopropyl-piperazin-2-one by heating

When you are using this chemical, please be cautious about it as the following:
This chemical is flammable, so you should keep it away from sources of ignition - No smoking. It can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. You must take off immediately all contaminated clothing. When using it, you need wear suitable protective clothing, gloves and eye/face protection, and you should avoid contact with eyes. In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: N(C(C)C)CCNC(C)C
(2)Std. InChI: InChI=1S/C8H20N2/c1-7(2)9-5-6-10-8(3)4/h7-10H,5-6H2,1-4H3
(3)Std. InChIKey: MFIGJRRHGZYPDD-UHFFFAOYSA-N