4,5,6-Pyrimidinetriamine

Basic Information

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CAS Number

118-70-7

Molecular Formula

C4H7N5

Molecular Weight

125.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

406.2℃ at 760 mmHg

Density

1.512

Flash Point

228.5°C

SMILES

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C1=NC(=C(C(=N1)N)N)N

InChI

InChI=1S/C4H7N5/c5-2-3(6)8-1-9-4(2)7/h1H,5H2,(H4,6,7,8,9)

InChIKey

MPNBXFXEMHPGTK-UHFFFAOYSA-N

LogP

-0.7767999999999999

Topological Polar Surface Area

103.83999999999999 Å²

Hydrogen Bond Donor/Acceptor

6 / 5

Complexity

Synonyms & References

English

Pyrimidine-4,5,6-triamine, AldrichCPR
MFCD00023271
4,5,6-triamino pyrimidine
FT-0645757
EN300-139311
4,5,6-Pyrimidinetriamine
AC-907/34115032
pyrimidine-4,5,6-triamine
Pyrimidine-4,5,6-triyltriamine
AMY321
4,6-Triaminopyrimidine
NSC145059
NSC-145059
AKOS002886089
CHEMBL2151973
4,5,6-Triaminopyrimidine
SB57399
DS-17223
UNII-PHL9UQ3Q4H
AC-26679
SY016488
Pyrimidine, 4,5,6-triamino-
DTXSID10151996
Pyrimidine,5,6-triamino-
Z1198147874
EINECS 204-270-2
SCHEMBL1718947
NSC 145059
InChI=1/C4H7N5/c5-2-3(6)8-1-9-4(2)7/h1H,5H2,(H4,6,7,8,9
118-70-7
J-514060

MDL Number

MFCD00023271

Customs Code

2933599090

FAQ

What regulatory guidelines apply to 4,5,6-Pyrimidinetriamine (CAS: 118-70-7)?

4,5,6-Pyrimidinetriamine (CAS: 118-70-7) must adhere to various regulatory guidelines. Under the GHS system, it is classified as a flammable liquid. In the European Union, it is regulated under REACH regulations, which require registration, evaluation, authorization, and restriction of chemicals. It is also subject to FDA and EPA requirements for safe handling, storage, and disposal in the United States. Proper labeling, hazard communication, and safe storage practices are essential to comply with these regulations.

Are there alternatives to 4,5,6-Pyrimidinetriamine (CAS: 118-70-7) in synthesis?

There are several alternatives to 4,5,6-Pyrimidinetriamine (CAS: 118-70-7) in synthesis, depending on the specific application. Common alternatives include other pyrimidine derivatives, such as pyrimidine-2,4,6-trione, and various amines. These alternatives can offer similar functionalities but with different reactivity and solubility profiles. It is important to evaluate the properties of each compound to determine the most suitable one for the intended synthesis.

What is the market or research trend for 4,5,6-Pyrimidinetriamine (CAS: 118-70-7)?

The market for 4,5,6-Pyrimidinetriamine (CAS: 118-70-7) is driven by its applications in pharmaceuticals, agrochemicals, and biotechnology. Recent research trends focus on its use as a precursor in the synthesis of various drugs and pesticides. The trend indicates a growing demand for optimized production methods and safer handling practices. Additionally, there is increasing interest in exploring its potential in gene therapy and cancer treatment.

How should waste containing 4,5,6-Pyrimidinetriamine (CAS: 118-70-7) be handled?

Waste containing 4,5,6-Pyrimidinetriamine (CAS: 118-70-7) should be collected and stored in appropriate containers to prevent spills and leakage. Safe disposal methods include incineration, neutralization, or professional waste disposal services that comply with local regulations. Environmental protection measures, such as monitoring for residual compounds and implementing containment systems, are crucial to prevent pollution. It is essential to follow the guidelines set by local environmental agencies and ensure that all disposal activities are conducted safely and responsibly.