Home >> Chemicals Listing >> hot product list by E  

Ethanol,2,2'-iminobis-, N-tallow alkyl derivs., N-oxides (61791-46-6)

Identification
Name:Ethanol,2,2'-iminobis-, N-tallow alkyl derivs., N-oxides
Synonyms:N,N-Bis(2-hydroxyethyl)(tallowalkyl)amine oxide;
CAS:61791-46-6
EINECS: 105.13564
Molecular Formula: C4H11NO2
Molecular Weight: 105.13564
InChI: InChI=1/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2
Molecular Structure: (C4H11NO2) N,N-Bis(2-hydroxyethyl)(tallowalkyl)amine oxide;
Properties
Melting Point: 28 DEG C
Flash Point: 268.389 ºC at 760 mmHg
Boiling Point: 268.389 ºC at 760 mmHg
Density:1.069 g/cm3
Solubility:VERY SOL IN ALC
MISCIBLE WITH WATER, METHANOL WATER; SOL IN BENZENE: 4.2% @ 25 DEG C; IN ETHER: 0.8% @ 25 DEG C; IN N-HEPTANE: LESS THAN 0.1% @ 25 DEG C; IN CARBON TETRACHLORIDE: LESS THAN 0.1% @ 25 DEG C
Specification:

The Ethanol,2,2'-iminobis-, N-tallow alkyl derivs., N-oxides, with the CAS registry number 61791-46-6, has the IUPAC name of 2-(2-hydroxyethylamino)ethanol. And its systematic name is 2,2'-iminodiethanol.
 
The physical properties of this chemical are as below: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 52.49; (10)Index of Refraction: 1.466; (11)Molar Refractivity: 27.245 cm3; (12)Molar Volume: 98.39 cm3; (13)Polarizability: 10.801 ×10-24 cm3; (14)Surface Tension: 43.521 dyne/cm; (15)Density: 1.069 g/cm3; (16)Flash Point: 137.778 °C; (17)Enthalpy of Vaporization: 58.808 kJ/mol; (18)Boiling Point: 268.389 °C at 760 mmHg; (19)Vapour Pressure: 0.001 mmHg at 25°C; (20)Exact Mass: 105.078979; (21)MonoIsotopic Mass: 105.078979; (22)Topological Polar Surface Area: 52.5; (23)Heavy Atom Count: 7; (24)Complexity: 28.9.

In addition, you could obtain the molecular structure by using the following datas:
(1)Canonical SMILES: C(CO)NCCO
(2)InChI: InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2
(3)InChIKey: ZBCBWPMODOFKDW-UHFFFAOYSA-N 

Flash Point: 268.389 ºC at 760 mmHg
Color: PRISMS
USUALLY OFFERED AS A VISCOUS LIQUID
CRYSTALLINE SOLID
Colorless crystals or a syrupy, white liquid (above 82 degrees F).
Safety Data