Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester

Base Information

Chemical Name:Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester
CAS No.:87970-06-7
Molecular Formula:C₁₄H₁₉N₅O₅
Molecular Weight:337.335
Hs Code.:
DSSTox Substance ID:DTXSID901007886
Wikidata:Q83004156

Synonyms:87970-06-7;Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester;DTXSID901007886;9-(2-O-Butanoylpentofuranosyl)-9H-purin-6-amine;[(2R,3S,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] butanoate

Suppliers and Price of Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester

Chemical Property:

Vapor Pressure:1.35E-16mmHg at 25°C
Boiling Point:627.2°C at 760 mmHg
Flash Point:333.1°C
Density:1.7g/cm³
XLogP3:0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:337.13861872
Heavy Atom Count:24
Complexity:455

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=O)OC1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O
Isomeric SMILES:CCCC(=O)O[C@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)CO)O

Technology Process of Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester

There total 3 articles about Butyric acid 2-(6-amino-purin-9-yl)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 78.0%

: 87970-05-6
9-<2-O-butyryl-3,5-bis-O-(tert-butyldimethylsilyl)-β-D-arabinofuranosyl>adenine

: 87970-06-7
9-(2-O-butyryl-β-D-arabinofuranosyl)adenine

Guidance literature:: With tetrabutyl ammonium fluoride; acetic acid; In tetrahydrofuran;
DOI:10.1021/jm00369a007

Reference yield:

: 82870-42-6
9-<3,5-bis-O-(tert-butyldimethylsilyl)-β-D-arabinofuranosyl>adenine

: 87970-06-7
9-(2-O-butyryl-β-D-arabinofuranosyl)adenine

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / pyridine / 48 h / 0 - 5 °C

2: 78 percent / n-Bu₄NF, glacial AcOH / tetrahydrofuran

With pyridine; tetrabutyl ammonium fluoride; acetic acid; In tetrahydrofuran;
DOI:10.1021/jm00369a007

Reference yield:

: 5536-17-4
arabinosyl adenine

: 87970-06-7
9-(2-O-butyryl-β-D-arabinofuranosyl)adenine

Guidance literature:: Multi-step reaction with 3 steps

1: 76.4 percent / Et₃N / dimethylformamide / 36 h / Ambient temperature

2: 92 percent / pyridine / 48 h / 0 - 5 °C

3: 78 percent / n-Bu₄NF, glacial AcOH / tetrahydrofuran

With pyridine; tetrabutyl ammonium fluoride; acetic acid; triethylamine; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1021/jm00369a007