1,4,7-Triazonane

Basic Information

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CAS Number

4730-54-5

Molecular Formula

C6H15N3

Molecular Weight

129.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

45°C

Boiling Point

113°C/7mmHg

Refractive Index

1.4620 (estimate)

Vapor Pressure

0.0±0.5 mmHg at 25°C

SMILES

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C1CNCCNCCN1

InChI

InChI=1S/C6H15N3/c1-2-8-5-6-9-4-3-7-1/h7-9H,1-6H2

InChIKey

ITWBWJFEJCHKSN-UHFFFAOYSA-N

LogP

-1.2311999999999985

Topological Polar Surface Area

36.089999999999996 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

45.1

Safety Information

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GHS Hazard Pictograms

H314

Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Sensitiveness

prone to moisture absorption

Synonyms & References

English

NSC 681101
CHEBI:37405
NCI60_028927
EN300-213777
HY-W006212
tacn
AMY31179
Q4545690
1H-1,4,7-Triazonine, octahydro-
BIDD:GT0562
MFCD00012358
CS-W006212
NSC-681101
DTXSID50197095
H10640
T1878
Triethylenetriamine
NSC681101
Octahydro-1H-1,4,7-triazonine
SCHEMBL132539
BCP06998
UNII-2UIF93C5H3
AKOS006220515
1,4,7-Triazacyclononane
CHEMBL1650628
4730-54-5
83834-39-3
FT-0635415
ITWBWJFEJCHKSN-UHFFFAOYSA-N
1,4,7-Triazacyclononane, 95%
2UIF93C5H3

MDL Number

MFCD00012358

Customs Code

2933990090

FAQ

What is 1,4,7-Triazonane (CAS: 4730-54-5)?

1,4,7-Triazonane is a cyclic organic compound with the chemical formula C3N3. It is a colorless, odorless, and highly reactive compound. 1,4,7-Triazonane is known for its thermal instability and reactivity with various functional groups.

What are the main uses of 1,4,7-Triazonane (CAS: 4730-54-5)?

1,4,7-Triazonane is primarily used in organic synthesis as a precursor to other nitrogen-containing compounds. It can participate in various chemical reactions, making it valuable in the development of new drugs and materials but is not widely used in commercial or industrial applications.

Is 1,4,7-Triazonane (CAS: 4730-54-5) safe?

1,4,7-Triazonane is highly reactive and toxic. It should be handled with caution in a well-ventilated environment, and appropriate personal protective equipment (PPE) should be worn. Exposures can cause severe irritation, and it is flammable. Safety standards and guidelines must be strictly followed to prevent accidents.

How should 1,4,7-Triazonane (CAS: 4730-54-5) be stored?

1,4,7-Triazonane should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. The storage area should have proper ventilation and be accessible only to authorized personnel. Avoid contact with incompatible materials such as acids and oxidizers.