Dicyclohexylthiourea
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Dicyclohexylthiourea
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CAS No:
1212-29-9
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Formula:
C13H24N2S
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Chemical Name:
Dicyclohexylthiourea
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Synonyms:
Thiourea,N,N′-dicyclohexyl-;Urea,1,3-dicyclohexyl-2-thio-;N,N′-Dicyclohexylthiourea;sym-Dicyclohexylthiourea;1,3-Dicyclohexylthiourea;N,N′-Dicyclohexylthiocarbamide;1,3-Dicyclohexyl-2-thiourea;Dicyclohexylthiourea;1,3-Bis(cyclohexyl)thiourea;NSC 33443
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CAS No:
Description
White crystals.
N,n'-dicyclohexylthiourea appears as white crystals. (NTP, 1992)
N,n'-dicyclohexylthiourea appears as white crystals. (NTP, 1992)
Dicyclohexylthiourea Basic Attributes
240.41
240.41
517587
214-920-7
854CTM0T34
33443
2811
DTXSID9020451
2930909090
Characteristics
56.2
3.77
N,n'-dicyclohexylthiourea appears as white crystals. (NTP, 1992)
1.0285 (rough estimate)
180-181 °C @ Solvent: Ethanol
345.3±25.0 °C(Predicted)
162.6±23.2 °C
1.5700 (estimate)
H2O: <0.01 g/100 mL at 21 ºC
Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage.
6.23E-05mmHg at 25°C
This chemical may be sensitive to prolonged exposure to air. Insoluble in water.
Amides and Imides
N,N'-DICYCLOHEXYLTHIOUREA is an amide. Amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx). This compound is incompatible with acids and oxidizing agents. It reacts with water. (NTP, 1992)
Safety Information
III
2811
22
22-36/37
YS9300000
P264, P270, P273, P301+P312, P330, P501
H302
DHEW/NCI; Bioassay of N,N'-Dicyclohexylthiourea for Possible Carcinogenicity (1978) Technical Rpt Series No. 56 DHEW Pub No. (NIH) 78-1362
Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
|Warning|H302 (11.36%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids. SPILL: Increase, in the downwind direction, as necessary, the isolation distance shown above. FIRE: If tank, rail car or tank truck is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directions; also, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2016)
SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. STORAGE PRECAUTIONS: You should keep this material in a tightly closed container under an inert atmosphere, and store it at refrigerated temperatures. (NTP, 1992)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
Toxicity
LD50 Rat oral 500 mg/kg
Groups of 50 Fischer 344 rats and 50 B6C3F1 mice of each sex were administered N,N'-dichlohexylthiourea /in feed/ at one of two doses, either 25,000 or 50,000 ppm, for 109 weeks for rats or 104 weeks for mice. Matched controls consisted of 50 untreated rats or 50 untreated mice of each sex. An increase in proliferative lesions of the follicular cells of the thyroid was associated with the administration of N,N'-dicyclohexylthiourea in both Fischer 344 rats and B6C3F1 mice. However, because statistical significance was not achieved and because thyroid tumors are not rare spontaneous lesions in these strains of animals and occur with a variable incidence, it is concluded that under the conditions of this bioassay N,N'-dicyclohexylthiourea was not demonstrated to be carcinogenic in either species.
4.37
Drug Information
ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits very toxic fumes. (NTP, 1992)
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment. INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing. INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)
In the manufacture of rubber, irritant contact dermatitis may occur from a variety of acids, alkalies, detergents, and solvents used in the process. Allergic contact dermatitis occurs not infrequently and is almost always due to an organic accelerator or antioxidant. While the list of potential sensitizing accelerators and antioxidants is enormous, common allergens include ... thioureas. /Thioureas/
N,N'-dicyclohexylthiourea
Dicyclohexylthiourea Use and Manufacturing
CHEM INT FOR DICYCLOHEXYLCARBODIIMIDE (NO EVIDENCE OF CURRENT USE)
(1977) NOT PRODUCED COMMERCIALLY IN USA|(1979) NOT PRODUCED COMMERCIALLY IN USA
Thiourea, N,N'-dicyclohexyl-: INACTIVE|BIOCIDAL ADDITIVE FOR CUTTING FLUIDS.
Computed Properties
Molecular Weight:240.41
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:240.16601995
Monoisotopic Mass:240.16601995
Topological Polar Surface Area:56.2
Heavy Atom Count:16
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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