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Ethylene thiourea
- CAS:96-45-7
- MW:102.155
- MF:C3H6N2S
Ethylene thiourea is a white to light green, needle-like crystalline solid with a faint amine odor. It is very soluble in hot water;slightly soluble in cold water, methanol, ethanol, ethylene glycol, pyridine, acetic acid, and naphtha; and insoluble in acetone, ether, chloroform, and benzene.When heated to decomposition, ethylene thiourea emits toxic fumes of nitrogen oxides (NOx) and sulfur oxides (SOx).
Ethylene thiourea is available in the United States as crystals, as a powder,
The 2-Imidazolidinethione is an organic compound with the formula?C3H6N2S. The IUPAC name of this product is?imidazolidine-2-thione?. With the CAS registry number 96-45-7, it is also named as 1,3-Ethylene-2-thiourea ;? 4,5-Dihydro-2-mercaptoimidazole ;?Akrochem etu-22 ;?Ethylene thiourea ;?Mercaptoimidazoline ;?Sodium-22 neoprene accelerator ;?Tetrahydro-2H-imidazole-2-thione ;?Urea, 1,3-ethylene-2-thio- ;?Vulkacit NPV/C ;?NA-22-D .
The 2-Imidazolidinethione is white to pale green crystalline powder?which is slightly soluble in water.?It is?odorless when pure, but technical product may have an amine odor.?This product is combustible. It is incompatible with acids and reducing agents.?And it can?react with acids to liberate hydrogen sulfide. In additoin, it may be sensitive to prolonged exposure to light.????
This product is used as rubber accelerator of neoprene rubber, chlorosulfonated polyethylene rubber, chlorine alcohol rubber and?polyacrylate rubber.?It is also?used as brightener for copper plating and often used in conjunction with acid copper plating brightener M, SPS, etc.?2-Imidazolidinethione is harmful if swallowed.?It may cause harm to the unborn child.?In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)?Avoid exposure - obtain special instructions before use.?
The 2-Imidazolidinethione?can be obtained by the following method. Adding 24 kg?ethylenediamine , 48 kg industrial alcohol , 60 kg?distilled water to reactor?successively. Stirring, slowly adding 32 kg CS2?and?controlling the?temperature at about 60 °C in the dropping process. Warming up to?100 °C after dropping, refluxing 1 h. Then adding 3.6 kg concentrated hydrochloric acid to reflux 9 ~ 10 h. Cooling crystallization. The product?is washed with acetone . The yield?is about 80%?- 85%.
The other characteristics of this product can be summarized as:?(1)ACD/LogP: -0.66 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -0.66 ; (4)ACD/LogD (pH 7.4): -0.66 ; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 1 ; (7)ACD/KOC (pH 5.5): 10.42 ; (8)ACD/KOC (pH 7.4): 10.42 ; (9)#H bond acceptors: 2 ; (10)#H bond donors: 2 ; (11)Index of Refraction: 1.625 ; (12)Molar Refractivity: 28.3 cm3 ; (13)Molar Volume: 79.9 cm3 ; (14)Polarizability: 11.21×10-24 cm3 ; (15)Surface Tension: 61.1 dyne/cm ; (16)Enthalpy of Vaporization: 38.52 kJ/mol ; (17)Vapour Pressure: 4.26 mmHg at 25°C ; (18)Tautomer Count: 2 ; (19)Exact Mass: 102.025169 ; (20)MonoIsotopic Mass: 102.025169 ; (21)Topological Polar Surface Area: 56.2 ; (22)Heavy Atom Count: 6. People can use the following data to convert to the molecule structure.?SMILES: S=C1NCCN1;?InChI: InChI=1/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6).
The following is the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | ? | National Technical Information Service. Vol. AD277-689, |
mouse | LD50 | oral | 3gm/kg (3000mg/kg) | ? | Teratology, The International Journal of Abnormal Development. Vol. 21, Pg. 71, 1980. |
mouse | LD50 | unreported | 7800mg/kg (7800mg/kg) | ? | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(5), Pg. 59, 1986. |
rat | LD50 | oral | 1832mg/kg (1832mg/kg) | ? | Bulletin of Environmental Contamination and Toxicology. Vol. 7, Pg. 19, 1972. |
The 2-Imidazolidinethione is an organic compound with the formula?C3H6N2S. The IUPAC name of this product is?imidazolidine-2-thione?. With the CAS registry number 96-45-7, it is also named as 1,3-Ethylene-2-thiourea ;? 4,5-Dihydro-2-mercaptoimidazole ;?Akrochem etu-22 ;?Ethylene thiourea ;?Mercaptoimidazoline ;?Sodium-22 neoprene accelerator ;?Tetrahydro-2H-imidazole-2-thione ;?Urea, 1,3-ethylene-2-thio- ;?Vulkacit NPV/C ;?NA-22-D .
The 2-Imidazolidinethione is white to pale green crystalline powder?which is slightly soluble in water.?It is?odorless when pure, but technical product may have an amine odor.?This product is combustible. It is incompatible with acids and reducing agents.?And it can?react with acids to liberate hydrogen sulfide. In additoin, it may be sensitive to prolonged exposure to light.????
This product is used as rubber accelerator of neoprene rubber, chlorosulfonated polyethylene rubber, chlorine alcohol rubber and?polyacrylate rubber.?It is also?used as brightener for copper plating and often used in conjunction with acid copper plating brightener M, SPS, etc.?2-Imidazolidinethione is harmful if swallowed.?It may cause harm to the unborn child.?In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)?Avoid exposure - obtain special instructions before use.?
The 2-Imidazolidinethione?can be obtained by the following method. Adding 24 kg?ethylenediamine , 48 kg industrial alcohol , 60 kg?distilled water to reactor?successively. Stirring, slowly adding 32 kg CS2?and?controlling the?temperature at about 60 °C in the dropping process. Warming up to?100 °C after dropping, refluxing 1 h. Then adding 3.6 kg concentrated hydrochloric acid to reflux 9 ~ 10 h. Cooling crystallization. The product?is washed with acetone . The yield?is about 80%?- 85%.
The other characteristics of this product can be summarized as:?(1)ACD/LogP: -0.66 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -0.66 ; (4)ACD/LogD (pH 7.4): -0.66 ; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 1 ; (7)ACD/KOC (pH 5.5): 10.42 ; (8)ACD/KOC (pH 7.4): 10.42 ; (9)#H bond acceptors: 2 ; (10)#H bond donors: 2 ; (11)Index of Refraction: 1.625 ; (12)Molar Refractivity: 28.3 cm3 ; (13)Molar Volume: 79.9 cm3 ; (14)Polarizability: 11.21×10-24 cm3 ; (15)Surface Tension: 61.1 dyne/cm ; (16)Enthalpy of Vaporization: 38.52 kJ/mol ; (17)Vapour Pressure: 4.26 mmHg at 25°C ; (18)Tautomer Count: 2 ; (19)Exact Mass: 102.025169 ; (20)MonoIsotopic Mass: 102.025169 ; (21)Topological Polar Surface Area: 56.2 ; (22)Heavy Atom Count: 6. People can use the following data to convert to the molecule structure.?SMILES: S=C1NCCN1;?InChI: InChI=1/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6).
The following is the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | ? | National Technical Information Service. Vol. AD277-689, |
mouse | LD50 | oral | 3gm/kg (3000mg/kg) | ? | Teratology, The International Journal of Abnormal Development. Vol. 21, Pg. 71, 1980. |
mouse | LD50 | unreported | 7800mg/kg (7800mg/kg) | ? | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(5), Pg. 59, 1986. |
rat | LD50 | oral | 1832mg/kg (1832mg/kg) | ? | Bulletin of Environmental Contamination and Toxicology. Vol. 7, Pg. 19, 1972. |
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