CAS No.13093-05-5,N,N'-DIETHYL-1,6-DIAMINOHEXANE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13093-05-5
Name:	N,N'-DIETHYL-1,6-DIAMINOHEXANE
Article Data:	12

Formula:	C₁₀H₂₄N₂
Molecular Weight:	172.314
Synonyms:	1,6-Hexanediamine, N,N'-diethyl-;1,6-Bis(ethylamino)hexane;N,N'-Diethylhexamethylenediamine;N,N'-Diethylhexylenediamine;1,6-Hexanediamine,N,N'-diethyl- (6CI,8CI,9CI);
EINECS:	236-006-7
Density:	0.815 g/cm³
Melting Point:	259-260 °C
Boiling Point:	233.8 °C at 760 mmHg
Flash Point:	105.1 °C
PSA:	24.06000
LogP:	2.54760

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Specification

The CAS registry number of 1,6-Hexanediamine,N1,N6-diethyl- is 13093-05-5. The IUPAC name is N,N'-diethylhexane-1,6-diamine. Its EINECS registry number is 236-006-7. In addition, the molecular formula is C₁₀H₂₄N₂ and the molecular weight is 172.31. It should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 1.57; (2)ACD/LogD (pH 5.5): -2.53; (3)ACD/LogD (pH 7.4): -2.52; (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: 2; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 6.48 Å²; (12)Index of Refraction: 1.439; (13)Molar Refractivity: 55.56 cm³; (14)Molar Volume: 211.2 cm³; (15)Polarizability: 22.02 ×10^-24cm³; (16)Surface Tension: 28 dyne/cm; (17)Density: 0.815 g/cm³; (18)Flash Point: 105.1 °C; (19)Enthalpy of Vaporization: 47.05 kJ/mol; (20)Boiling Point: 233.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0549 mmHg at 25°C.

Preparation of 1,6-Hexanediamine,N1,N6-diethyl-: it can be prepared by N,N'-hexanediyl-bis-acetamide. This reaction will need reagent lithium aluminium hydride and solvent diethyl ether. The reaction time is 18 hours by heating. The yield is about 35%.

Uses of 1,6-Hexanediamine,N1,N6-diethyl-: it can react with isocyanatobenzene to get 1,6-bis-(1-ethyl-3-phenylureido-1-yl)hexane. This reaction will need solvent CHCl₃. The reaction time is 1 hour with ambient temperature. The yield is about 91%.

You can still convert the following datas into molecular structure:
(1)SMILES: N(CC)CCCCCCNCC
(2)InChI: InChI=1/C10H24N2/c1-3-11-9-7-5-6-8-10-12-4-2/h11-12H,3-10H2,1-2H3
(3)InChIKey: LDQWVRMGQLAWMN-UHFFFAOYAJ