CAS No.4385-04-0,N,N-DIMETHYLHEXYLAMINE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	4385-04-0
Name:	N,N-DIMETHYLHEXYLAMINE
Article Data:	55

Formula:	C₈H₁₉N
Molecular Weight:	129.246
Synonyms:	Hexylamine,N,N-dimethyl- (6CI,7CI,8CI);1-(Dimethylamino)hexane;Hexyldimethylamine;N,N-Dimethyl-1-hexanamine;N,N-Dimethyl-n-hexylamine;N,N-Dimethylhexylamine;N-Hexyldimethylamine;
EINECS:	224-491-8
Density:	0.77 g/cm³
Melting Point:	-76.53°C (estimate)
Boiling Point:	147.1 °C at 760 mmHg
Flash Point:	33.3 °C
Appearance:	colourless liquid
Hazard Symbols:	C
Risk Codes:	10-34
Safety:	26-36/37/39-45
Transport Information:	UN 2733 3/PG 3
PSA:	3.24000
LogP:	2.12830

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Specification

This chemical is called 1-Hexanamine,N,N-dimethyl-, and it can also be named as 1-(Dimethylamino)hexane. With the molecular formula of C₈H₁₉N, its molecular weight is 129.24. The CAS registry number of this chemical is 4385-04-0, and its product categories are Amines; C8; Nitrogen Compounds. Additionally, this chemical should be sealed in the container, avoided direct sunshine and stored in the ventilated and dry place.

Other characteristics of the 1-Hexanamine,N,N-dimethyl- can be summarised as follows: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.36; (4)ACD/LogD (pH 7.4): 0.25; (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): 2.42; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.424; (14)Molar Refractivity: 42.83 cm³; (15)Molar Volume: 167.8 cm³; (16)Polarizability: 16.98×10^-24cm³; (17)Surface Tension: 25.2 dyne/cm; (18)Density: 0.77 g/cm³; (19)Flash Point: 33.3 °C; (20)Enthalpy of Vaporization: 38.41 kJ/mol; (21)Boiling Point: 147.1 °C at 760 mmHg; (22)Vapour Pressure: 4.49 mmHg at 25°C.

Production method of this chemical: 1-Hexanamine,N,N-dimethyl- could be obtained by the reactants of methanol and hexylamine. This reaction needs the reagent of RuCl₂(PPh₃)₃. The yield is 88%. In addition, this reaction should be taken for 7 hours at the temperature of 180 °C.

Uses of this chemical: The N,N-dimethylhexylamine-N-oxide could be obtained by the reactant of 1-Hexanamine,N,N-dimethyl-. This reaction needs the reagent of H₂O₂, and the solvents of H₂O and methanol. The yield is 68 %.

When you are using this chemical, please be cautious about it as follows: It is flammable and it causes burns. When you use it, you should wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, in case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
1.SMILES: N(CCCCCC)(C)C
2.InChI: InChI=1/C8H19N/c1-4-5-6-7-8-9(2)3/h4-8H2,1-3H3
3.InChIKey: QMHNQZGXPNCMCO-UHFFFAOYAN