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Imidazoline

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Name

Imidazoline

EINECS N/A
CAS No. 504-75-6 Density 1.15g/cm3
PSA 24.39000 LogP -0.61770
Solubility N/A Melting Point 55°C
Formula C3H6 N2 Boiling Point 219.1°Cat760mmHg
Molecular Weight 70.094 Flash Point 86.3°C
Transport Information N/A Appearance N/A
Safety Poison by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx. Risk Codes N/A
Molecular Structure Molecular Structure of 504-75-6 (4,5-dihydro-1H-imidazole) Hazard Symbols N/A
Synonyms

2-Imidazoline(6CI,7CI,8CI); 4,5-Dihydroimidazole; Corban 210WS; Imidazoline; D2-Imidazoline

Article Data 39

Imidazoline Synthetic route

96-45-7

N,N'-ethylenethiourea

A

504-75-6

2-imidazoline

B

120-93-4

imidazolidone

Conditions
ConditionsYield
With 3,3-dimethyldioxirane In methanol; acetone at 25℃;A 53%
B 15%
201230-82-2

carbon monoxide

107-15-3

ethylenediamine

A

504-75-6

2-imidazoline

B

120-93-4

imidazolidone

C

109-58-0

N-β-aminoethylcarbamic acid

Conditions
ConditionsYield
With tetracarbonyl nickel In ethanol at 160℃; for 18h;A 28%
B 10.6%
C 31.7%
With tetracarbonyl nickel In ethanol at 160℃; for 18h;A 28%
B 10.6%
C 31.7%
290-87-9

1,3,5-Triazine

107-15-3

ethylenediamine

504-75-6

2-imidazoline

96-45-7

N,N'-ethylenethiourea

A

504-75-6

2-imidazoline

B

120-93-4

imidazolidone

C

64205-92-1

4,5-dihydro-1H-imidazole-2-sulfonic acid

Conditions
ConditionsYield
With dihydrogen peroxide; trifluoroacetic acid at 25℃;
504-75-6

2-imidazoline

N-butyl-2-iodobenzamide

A

1362191-54-5

C14H17N3O

B

1362191-28-3

C14H15N3O

Conditions
ConditionsYield
Stage #1: 2-imidazoline; N-butyl-2-iodobenzamide With caesium carbonate; L-proline In dimethyl sulfoxide for 0.333333h; Ullmann reaction; Inert atmosphere;
Stage #2: With copper(l) iodide In dimethyl sulfoxide at 120℃; for 12h; Ullmann reaction; Inert atmosphere;
A 88%
B n/a
504-75-6

2-imidazoline

13939-06-5, 199620-15-0

molybdenum hexacarbonyl

64121-72-8

cis-tetracarbonylbis(2-imidazoline-N)molybdenum(0)

64121-75-1

fac-tricarbonyltris(2-imidazoline-N)molybdenum(0)

Conditions
ConditionsYield
In toluene byproducts: CO; N2-atmosphere; 3 equiv. of imidazoline, 100°C, 10 min (pptn.); filtration, washing (Et2O), drying (vac.); elem. anal.; bis(imidazoline)-complex from filtrate;A 20%
B 75%
504-75-6

2-imidazoline

177662-53-2

2-methyl-5-[4-hydroxy-1-[4-(methylsulfonyl)phenyl]-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-2-yl]pyridine

177660-80-9

2-methyl-5-[1-[4-(methylsulfonyl)phenyl]-4-trifluoromethyl-1H-imidazol-2-yl]pyridine

Conditions
ConditionsYield
With p-toluenesulfonic acid monohydrate In ethyl acetate; acetone; toluene66%
420-12-2

thirane

504-75-6

2-imidazoline

2-imidazolinylethanethiol

Conditions
ConditionsYield
In toluene for 48h; Heating;62%
504-75-6

2-imidazoline

12092-47-6

di-μ-chloro-bis(1,5-cyclooctadiene)dirhodium

67012-40-2

chloro(cyclo-octa-1,5-diene)(2-imidazoline-N)rhodium(I)

Conditions
ConditionsYield
In toluene N2-atmosphere; stoich. amts., refluxing for 1 h; crystn. (-20°C), addn. of hexane, collection (filtration), washing (Et2O), drying (vac.); elem. anal.;55%
504-75-6

2-imidazoline

177662-51-0

4-[4-hydroxy-1-[4-(methylsulfonyl) phenyl]-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-2-yl]pyridine

177660-79-6

4-[1-[4-(methylsulfonyl)phenyl]-4-(trifluoromethyl)-1H-imidazol-2-yl]pyridine

Conditions
ConditionsYield
With p-toluenesulfonic acid monohydrate In ethyl acetate; acetone; toluene41%

Imidazoline Chemical Properties

IUPAC: 4,5-Dihydro-1H-imidazole
 Imidazoline with CAS NO. of 504-75-6 is also called for 2-Imidazoline ; 4,5-Dihydro-1H-imidazole ; 1H-Imidazole, 4,5-dihydro- ; CHEBI:53094 ; CID68156 ; EINECS 207-999-4 ; 504-75-6 and so on.
Molecular Weight: 70.09
Molecular Formula: C3H6N2
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -3.08 
ACD/LogD (pH 7.4): -3.07 
ACD/BCF (pH 5.5): 1 
ACD/BCF (pH 7.4): 1 
ACD/KOC (pH 5.5): 1 
ACD/KOC (pH 7.4): 1 
H bond acceptors: 2 
H bond donors: 1 
Freely Rotating Bonds: 0
Heavy Atom Count: 5
Formal Charge: 0
Complexity: 48.9
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Index of Refraction: 1.568 
Molar Refractivity: 19.92 cm
Molar Volume: 60.8 cm
Surface Tension: 41.8 dyne/cm 
Density: 1.15 g/cm3 
Flash Point: 86.3°C 
Enthalpy of Vaporization: 45.55 kJ/mol 
Boiling Point: 219.1°C at 760 mmHg 
Vapour Pressure: 0.122 mmHg at 25°C 
The molecular structure of  Imidazoline with CAS NO. of  504-75-6 :

Imidazoline Uses

 Imidazoline (CAS NO.504-75-6) is found in the commercially available second generation Grubbs' catalyst.

Imidazoline Toxicity Data With Reference

1.    

ipr-mus LD50:50 mg/kg

    AMRL**    Aerospace Medical Research Laboratory Report.(Aerospace Technical Div., Air Force Systems Command, Wright-Patterson Air Force Base, OH 45433)

Imidazoline Consensus Reports

Reported in EPA TSCA Inventory.

Imidazoline Safety Profile

Poison by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx.

Imidazoline Specification

1.Removal in wastewater treatment of Imidazoline (CAS NO.504-75-6):
Total removal:1.87  percent
Total biodegradation:0.09  percent
Total sludge adsorption:1.76  percent
Total to air:0.03  percent
(using 10000 hr Bio P,A,S)
2. Imidazoline (CAS NO.504-75-6) is a nitrogen-containing heterocycle which is derived from imidazole.The ring contains an imine bond, and the carbons at the 4 and 5 positions are singly bonded, rather than doubly bonded for the case of imidazole.

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