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Home > Encyclopedia > Diaminomaleonitrile

Diaminomaleonitrile

Diaminomaleonitrile structure

Diaminomaleonitrile 

structure
  • CAS No:

    1187-42-4

  • Formula:

    C4H4N4

  • Chemical Name:

    Diaminomaleonitrile

  • Synonyms:

    2-Butenedinitrile,2,3-diamino-,(2Z)-;Maleonitrile,diamino-;2-Butenedinitrile,2,3-diamino-,(Z)-;(2Z)-2,3-Diamino-2-butenedinitrile;Diaminomaleonitrile;Hydrogen cyanide tetramer;2,3-Diaminomaleonitrile;DAMN;Diaminomaleodinitrile;54414-88-9

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

PHYSICAL DESCRIPTION: Brown powder. (NTP, 1992)


Diaminomaleonitrile is a brown powder. (NTP, 1992)


Diaminomaleonitrile is a brown powder. (NTP, 1992)

Diaminomaleonitrile Basic Attributes

108.1

108.10

214-697-6

E8C63N8TWR

266758

2811

DTXSID0024923

2926909090

Characteristics

99.6

-1

Diaminomaleonitrile is a brown powder. (NTP, 1992)

1.3±0.1 g/cm3

182-184 °C

444.7ºC at 760 mmHg

222.7±28.7 °C

1.579

less than 1 mg/mL at 63° F (NTP, 1992)

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from light.

0.159mmHg at 25°C

Insoluble in water.

Amines, Phosphines, and Pyridines

DIAMINOMALEONITRILE is sensitive to prolonged exposure to air. (NTP, 1992)

Safety Information

6.1

3439

3

6.1

S36-S24/25

T:Toxic;

Stable under normal temperatures and pressures.

P280

H302 + H312 + H332

Flash point data are not available for this compound, but it is probably combustible. (NTP, 1992)

|Danger|H301 (18.18%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P311, P312, P321, P322, P330, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 88 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Fires involving this compound should be controlled using 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, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol 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 alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminate 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 a combination filter cartridge, i.e. organic vapor/acid gas/HEPA (specific for organic vapors, HCl, acid gas, SO2 and a high efficiency particulate filter). (NTP, 1992)

Drug Information

Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: TOXIC; inhalation, ingestion or skin contact with material may cause severe injury or death. Contact with molten substance may cause severe burns to skin and eyes. Avoid any skin contact. Effects of contact or inhalation may be delayed. Fire may produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause pollution. (ERG, 2016)

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. IMMEDIATELY call a physician and be prepared to transport the victim to a hospital even if no symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop. 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: 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. Generally, the induction of vomiting is NOT recommended outside of a physician's care due to the risk of aspirating the chemical into the victim's lungs. However, if the victim is conscious and not convulsing and if medical help is not readily available, consider the risk of inducing vomiting because of the high toxicity of the chemical ingested. Ipecac syrup or salt water may be used in such an emergency. IMMEDIATELY transport the victim to a hospital. 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)

diaminomaleonitrile

Diaminomaleonitrile Use and Manufacturing

Methods of Manufacturing

In an autoclave, 10 g of NaCN is added to 130 ml of acetone cyanohydrin. Then 6.54 g of methanethiol is added. The solution is then stirred at 60° C. for 2 hours. The solution turns orange. The excess acetone cyanohydrin is then neutralized by adding soda. The solution is then filtered and evaporated to give an orange-yellow solid (amount recovered=33.7 g corresponding to a yield=88percent).

2-Butenedinitrile, 2,3-diamino-, (2Z)-: ACTIVE

Computed Properties

Molecular Weight:108.10
XLogP3:-1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Exact Mass:108.043596145
Monoisotopic Mass:108.043596145
Topological Polar Surface Area:99.6
Heavy Atom Count:8
Complexity:183
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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