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2-Thiothymine

2-Thiothymine structure

2-Thiothymine 

structure
  • CAS No:

    636-26-0

  • Formula:

    C5H6N2OS

  • Chemical Name:

    2-Thiothymine

  • Synonyms:

    4(1H)-Pyrimidinone,2,3-dihydro-5-methyl-2-thioxo-;Thymine,2-thio-;2,3-Dihydro-5-methyl-2-thioxo-4(1H)-pyrimidinone;2-Thiothymine;5-Methyl-2-thiouracil;Thiothymine;4-Hydroxy-5-methylpyrimidine-2-thione;4-Hydroxy-5-methyl-2-mercaptopyrimidine;NSC 314272;NSC 9377;5-Methyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

white crystalline powder


5-methyl-2-thiouracil is a white crystalline solid. (NTP, 1992)


5-methyl-2-thiouracil is a white crystalline solid. (NTP, 1992)

2-Thiothymine Basic Attributes

142.18

142.18

120488

9377

DTXSID9025665

2933599090

Characteristics

73.2

0.31

5-methyl-2-thiouracil is a white crystalline solid. (NTP, 1992)

1.36

330 °C

329.7ºC at 760 mmHg

153.2ºC

1.638

less than 1 mg/mL at 73° F (NTP, 1992)

Insoluble in water.

Amides and Imides

5-METHYL-2-THIOURACIL is heat sensitive and may be light sensitive.

Safety Information

22-40-36/37/38

22-36/37-26

XP2108500

Xi

Stable but may be heat or light sensitive. Incompatible with strong oxidizing agents.

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

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

|Warning|H315 (90.91%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, 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)

SMALL SPILLS AND LEAKAGE: If you spill this chemical, dampen the solid spill material with 5% ammonium hydroxide, then transfer the dampened material to a suitable container. Use absorbent paper dampened with 5% ammonium hydroxide to pick up any remaining material. Your contaminated clothing and the absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with 5% ammonium hydroxide 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 protect this chemical from exposure to light, and store it in a freezer. (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)

Drug Information

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)

2-thiothymine

2-Thiothymine Use and Manufacturing

Uses

Antithyroid drugs

4(1H)-Pyrimidinone, 2,3-dihydro-5-methyl-2-thioxo-: INACTIVE

Computed Properties

Molecular Weight:142.18
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:142.02008399
Monoisotopic Mass:142.02008399
Topological Polar Surface Area:73.2
Heavy Atom Count:9
Complexity:197
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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