1,4,7-Trimethyl-1,4,7-triazonane

Basic Information

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CAS Number

96556-05-7

Molecular Formula

C9H21N3

Molecular Weight

171.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

208 ºC

Density

0.884 g/mL at 25 °C

Refractive Index

n20/D 1.473(lit.)

SMILES

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CN1CCN(C)CCN(CC1)C

InChI

InChI=1S/C9H21N3/c1-10-4-6-11(2)8-9-12(3)7-5-10/h4-9H2,1-3H3

InChIKey

WLDGDTPNAKWAIR-UHFFFAOYSA-N

LogP

-0.204599999999999

Topological Polar Surface Area

9.72 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

91.2

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

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

Hazard Class

Class 8 Class 8

Sensitiveness

moisture sensitive

Synonyms & References

English

1,4,7-Trimethyl-1,4,7-triazonane
1,4,7-Trimethyl-1,4,7-triazacyclononane (stabilized with NaHCO3)
1,4,7-Trimethyl-1,4,7-triazacyclononane
Octahydro-1,4,7-trimethyl-1H-1,4,7-triazonine (stabilized with NaHCO3)
Octahydro-1,4,7-Trimethyl-1H-1,4,7-Triazonine
Octahydro-1,4,7-trimethyl-1H-1,4,7-triazonine (ACI)
N,N′,N′′-Trimethyl-1,4,7-triazacyclononane
TMTAN

MDL Number

MFCD00012359

Customs Code

2933990090

FAQ

What is 1,4,7-Trimethyl-1,4,7-triazonane (CAS: 96556-05-7)?

1,4,7-Trimethyl-1,4,7-triazonane is a cyclic compound with the chemical formula C7H12N3. It is characterized by its stability and unique molecular structure, featuring three methyl groups attached to a triazanane ring.

What are the main uses of 1,4,7-Trimethyl-1,4,7-triazonane (CAS: 96556-05-7)?

1,4,7-Trimethyl-1,4,7-triazonane is primarily used in the synthesis of other organic compounds, particularly in the pharmaceutical and chemical industries. It serves as a precursor for the production of various drug molecules and specialty chemicals.

Is 1,4,7-Trimethyl-1,4,7-triazonane (CAS: 96556-05-7) safe?

1,4,7-Trimethyl-1,4,7-triazonane is generally considered safe for handling under normal conditions. However, it should be handled with care due to its potential to cause skin and eye irritation. Wear gloves and protective eyewear when handling, and ensure proper ventilation in the work environment.

How should 1,4,7-Trimethyl-1,4,7-triazonane (CAS: 96556-05-7) be stored?

Store 1,4,7-Trimethyl-1,4,7-triazonane in a cool, dry place away from direct sunlight and heat sources. Keep the container tightly closed to prevent moisture absorption. The ideal storage temperature is between 10°C and 25°C. Avoid storing in high humidity areas to maintain its stability and prevent degradation.