Structure

1,4,7,10,13-PENTAAZACYCLOPENTADECANE

CAS
295-64-7
Catalog Number
ACM295647
Category
Main Products
Molecular Weight
215.34
Molecular Formula
C10H25N5

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Specification

Synonyms
1,4,7,10,13-pentazacyclopentadecane
Appearance
Yellow solid
What is the molecular formula of 1,4,7,10,13-pentazacyclopentadecane?

The molecular formula is C10H25N5.

What are the synonyms for 1,4,7,10,13-pentazacyclopentadecane?

The synonyms are 1,4,7,10,13-Pentaazacyclopentadecane, 295-64-7, 1,4,7,10,13-pentazacyclopentadecane, BRN 1210461, IPS108.

What is the molecular weight of 1,4,7,10,13-pentazacyclopentadecane?

The molecular weight is 215.34 g/mol.

When was 1,4,7,10,13-pentazacyclopentadecane created and last modified?

It was created on 2005-08-01 and last modified on 2023-10-21.

What is the IUPAC name of 1,4,7,10,13-pentazacyclopentadecane?

The IUPAC name is 1,4,7,10,13-pentazacyclopentadecane.

What is the InChI of 1,4,7,10,13-pentazacyclopentadecane?

The InChI is InChI=1S/C10H25N5/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h11-15H,1-10H2.

What is the InChIKey of 1,4,7,10,13-pentazacyclopentadecane?

The InChIKey is KDCBVVQAMMXRFB-UHFFFAOYSA-N.

What is the canonical SMILES of 1,4,7,10,13-pentazacyclopentadecane?

The canonical SMILES is C1CNCCNCCNCCNCCN1.

What is the CAS number of 1,4,7,10,13-pentazacyclopentadecane?

The CAS number is 295-64-7.

What is the XlogP3 value of 1,4,7,10,13-pentazacyclopentadecane?

The XlogP3 value is -2.8.

Upstream Synthesis Route 1

  • 52601-74-8
  • 295-64-7

Reference: [1] Synthetic Communications, 1999, vol. 29, # 16, p. 2817 - 2822
[2] Journal of Labelled Compounds and Radiopharmaceuticals, 2000, vol. 43, # 6, p. 585 - 594
[3] Chemistry of Heterocyclic Compounds (New York, NY, United States), 1990, vol. 26, # 3, p. 346 - 349[4] Khimiya Geterotsiklicheskikh Soedinenii, 1990, # 3, p. 401 - 404
[5] European Journal of Medicinal Chemistry, 1984, vol. 19, # 5, p. 425 - 431

Upstream Synthesis Route 2

  • 55442-07-4
  • 295-64-7

Reference: [1] European Journal of Medicinal Chemistry, 1984, vol. 19, # 5, p. 425 - 431
[2] Chemistry of Heterocyclic Compounds (New York, NY, United States), 1990, vol. 26, # 3, p. 346 - 349[3] Khimiya Geterotsiklicheskikh Soedinenii, 1990, # 3, p. 401 - 404

Upstream Synthesis Route 3

  • 112-24-3
  • 295-64-7

Reference: [1] European Journal of Medicinal Chemistry, 1984, vol. 19, # 5, p. 425 - 431

Upstream Synthesis Route 4

  • 52601-74-8
  • 295-64-7

Reference: [1]Synthetic Communications,1999,vol. 29,p. 2817 - 2822
[2]Journal of labelled compounds and radiopharmaceuticals,2000,vol. 43,p. 585 - 594
[3]Chemistry of Heterocyclic Compounds,1990,vol. 26,p. 346 - 349
Khimiya Geterotsiklicheskikh Soedinenii,1990,p. 401 - 404
[4]European Journal of Medicinal Chemistry,1984,vol. 19,p. 425 - 431

Downstream Synthesis Route 1

  • 75-21-8
  • 295-64-7
  • 85325-52-6

Reference: [1]Journal of the Chemical Society, Dalton Transactions,2002,p. 3571 - 3577
[2]Acta chemica Scandinavica. Series B: Organic chemistry and biochemistry,1984,vol. 38,p. 773 - 778

Downstream Synthesis Route 2

  • 295-64-7
  • 24463-19-2
  • 126257-27-0

Reference: [1]Journal of the American Chemical Society,1990,vol. 112,p. 3590 - 3593

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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