2-Deoxy-2-fluoro-alpha-d-arabinofuranosyl bromide 3,5-dibenzoate

CAS

97614-44-3

Catalog Number

ACM97614443

Category

Other Products

Molecular Formula

C₁₉H₁₆BrFO₅

MSDS COA Spec Sheet

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Specification

Synonyms

2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate

What is the molecular formula of 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The molecular formula is C19H16BrFO5.

When was 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate created and last modified in PubChem?

It was created on 2006-10-26 and last modified on 2023-12-30.

What is the IUPAC Name of 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The IUPAC Name is [(2R,3R,4S,5R)-3-benzoyloxy-5-bromo-4-fluorooxolan-2-yl]methyl benzoate.

How many hydrogen bond donor counts does 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate have?

It has 0 hydrogen bond donor counts.

What is the complexation of 2-Deoxy 2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The complexity is 490.

What is the XLogP3-AA value of 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The XLogP3-AA value is 4.4.

How many hydrogen bond acceptor counts does 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate have?

It has 6 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The topological polar surface area is 61.8?².

What is the heavy atom count of 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate?

The heavy atom count is 26.

How many defined atom stereocenter counts does 2-Deoxy-2-fluoro-alpha-D-arabinofuranosyl bromide 3,5-dibenzoate have?

It has 4 defined atom stereocenter counts.

Downstream Synthesis Route 1

97614-44-3

56632-83-8

Reference: [1] Nucleosides, Nucleotides and Nucleic Acids, 2005, vol. 24, # 5-7, p. 713 - 715

Downstream Synthesis Route 2

97614-44-3

69256-17-3

Reference: [1] Journal of Organic Chemistry, 1988, vol. 53, p. 85 - 88

Downstream Synthesis Route 3

97614-44-3

123318-82-1

Reference: [1] Organic Process Research and Development, 2004, vol. 8, # 6, p. 889 - 896
[2] Organic Process Research and Development, 2008, vol. 12, # 6, p. 1229 - 1237
[3] Patent: CN106397518, 2017, A,

Downstream Synthesis Route 4

67-56-1
97614-44-3

136315-44-1

Reference: [1]Wysocki Jr.; Siddiqui; Barchi Jr.; Driscoll; Marquez
[Synthesis, 1991, # 11, p. 1005 - 1008]
[2]Siddiqui; Driscoll; Marquez; Roth; Shirasaka; Mitsuya; Barchi Jr.; Kelley
[Journal of Medicinal Chemistry, 1992, vol. 35, # 12, p. 2195 - 2201]