1,4,7-Triazacyclononane

CAS
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Purity
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CAS
4730-54-5
Size
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Purity
96%
Price
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Catalog Number

ACM4730545-1

Product Name

1,4,7-Triazacyclononane

Structure

CAS

4730-54-5

Category

Heterocyclic Organic Compound

Synonyms

1,4,7-Triazonane; 1H-1,4,7-Triazonine, octahydro-

IUPAC Name

1,4,7-triazonane

Molecular Weight

129.20

Molecular Formula

C6H15N3

Canonical SMILES

C1CNCCNCCN1

InChI

ITWBWJFEJCHKSN-UHFFFAOYSA-N

InChI Key

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

Boiling Point

254.1 °C at 760 mmHg

Melting Point

42-45 °C -lit.

Appearance

White to light yellow solid

Storage

2-8°C

Complexity

45.1

Covalently-Bonded Unit Count

Exact Mass

129.126597491

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Monoisotopic Mass

129.126597491

NSC Number

681101

Rotatable Bond Count

Topological Polar Surface Area

36.1 Å²

UNII

2UIF93C5H3

MSDS

Download MSDS

COA

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Spec Sheet

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