1,3,5-Triazine-2,4,6-triol

Basic Information

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CAS Number

108-80-5

Molecular Formula

C3H3N3O3

Molecular Weight

129.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

>360 °C

Boiling Point

74 °C

Water Solubility

0.3 g/100mL (25 ºC)

Flash Point

433.6ºC

Solubility

Soluble in sulfuric acid, dimethylformamide, sodium hydroxide, potassium hydroxide and diemthyl sulfoxide. Slightly soluble in acetone, benzene, diethyl ether, ethanol and hexane. Insoluble in cold methanol, benzene and chloroform.

Refractive Index

1.4500 (estimate)

SMILES

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Oc1nc(O)nc(O)n1

InChI

InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9)

InChIKey

ZFSLODLOARCGLH-UHFFFAOYSA-N

LogP

-1.0116000000000003

pKa

6.88, 11.40, 13.5(at 25℃)

Topological Polar Surface Area

99.36000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

136

Safety Information

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GHS Hazard Pictograms

H319

H400

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Stability

Stable. Incompatible with strong oxidizing agents.

Sensitiveness

Sensitive to humidity

Toxicity

LD50 orally in rats: >5.00 g/kg (Canelli)

Synonyms & References

English

1,3,5-Triazine-2,4,6-triol
1,3,5-Triazin-2,4,6-triol
1,3,5-Triazinan-2,4,6-trion
1,3,5-Triazinane-2,4,6-trione
1,3,5-triazine-2,4,6(1H,3H,5H)-trione
isocyanuric acid
Cyanuric acid
Tricyanic acid
2,4,6-TRIFLUORO-1,3,5-TRIAZINE
1,3,5-triaza-cyclohexane-2,4,6-trione
1,3,5-Triazine-2,4,6-triol,2,4,6-Trihydroxy-1,3,5-triazine
1,3,5-triazine-2,4,6-trione
108-80
2,4,6-Trihydroxy-1,3,5-triazine
2,4,6-trioxo-s-triazine
cp4789
NorMal cyanuric acid
s-Triazinetriol
syM-Triazinetriol, 2,4,6-Trihydroxy-1,3,5-triazine, 1,3,5-triazine-2,4,6-triol
TRICARBIMIDE
Tricyanide
Trihydroxycyanidine
trihydroxytriazine
Triuret
Zeonet A
Trihydroxy-1,3,5-triazine
NSC 6284
Cyanursαure
Cyanauric Acid
sym-Triazinetriol
Pseudocyanuric acid

MDL Number

MFCD00082990

Customs Code

29336980

FAQ

What is 1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5)?

1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) is a heterocyclic compound with three hydroxyl groups attached to a triazine ring. Its chemical formula is C3H3N3O3, and it is characterized by its high reactivity due to the presence of multiple functional groups. This compound is commonly used as a synthetic intermediate in pharmaceutical and industrial applications.

What are the main uses of 1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5)?

1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) serves as a key precursor in the production of pharmaceuticals, particularly in drug synthesis involving nitrogen-containing compounds. It is also utilized in the manufacturing of agrochemicals, dyes, and specialty chemicals. Additionally, it finds applications in research for developing new materials and chemical derivatives.

Is 1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) safe?

1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) is generally considered safe when handled properly, but it may exhibit irritant properties. Safety guidelines include using appropriate personal protective equipment (PPE) and ensuring proper ventilation. It is important to follow established safety standards and avoid direct contact with skin or inhalation of vapors to minimize risks.

How should 1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) be stored?

1,3,5-Triazine-2,4,6-triol (CAS: 108-80-5) should be stored in a cool, dry place, preferably at 2-8°C, to maintain stability. It is sensitive to moisture and light, so airtight containers and dark storage conditions are recommended. Avoid exposure to heat and ensure proper humidity control to prevent degradation.