(2S,3R,4E)-2-Amino-4-decene-1,3-diol

Base Information

• Chemical Name: (2S,3R,4E)-2-Amino-4-decene-1,3-diol
• CAS No.: 235431-59-1
• Molecular Formula: C10H21NO2
• Molecular Weight: 187.27900
• DSSTox Substance ID: DTXSID90476457
• Wikidata: Q82307846
• Mol file: 235431-59-1.mol

Synonyms:(2S,3R,4E)-2-Amino-4-decene-1,3-diol;235431-59-1;(E,2S,3R)-2-aminodec-4-ene-1,3-diol;AKOS006290784;(2S,3R,E)-2-aminodec-4-ene-1,3-diol;SCHEMBL10102932;DTXSID90476457;(2S,3R,4E)-2-AMINODEC-4-ENE-1,3-DIOL;J-015144

Chemical Property of (2S,3R,4E)-2-Amino-4-decene-1,3-diol

Chemical Property:

• Boiling Point: 336.7±42.0 °C(Predicted)
• PKA: 11.86±0.45(Predicted)
• PSA: 66.48000
• Density: 1.003±0.06 g/cm3(Predicted)
• LogP: 1.50370
• Storage Temp.: -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly, Heated)
• XLogP3: 1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 187.157228913
• Heavy Atom Count: 13
• Complexity: 137

Purity/Quality:

99% ^*data from raw suppliers

(2S,3R,4E)-2-Amino-4-decene-1,3-diol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CC(C(CO)N)O
• Isomeric SMILES: CCCCC/C=C/[C@H]([C@H](CO)N)O
• Uses: An intermediate in the preparation of ceramide derivatives.

Technology Process of (2S,3R,4E)-2-Amino-4-decene-1,3-diol

There total 1 articles about (2S,3R,4E)-2-Amino-4-decene-1,3-diol 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: 98.0%

((E)-(1S,2R)-2-Hydroxy-1-hydroxymethyl-non-3-enyl)-carbamic acid tert-butyl ester (646035-22-5) → 10-carbon-sphingosine (235431-59-1)

Guidance literature:

With trifluoroacetic acid; for 0.5h;

DOI:10.1055/s-2003-42094

Reference yield:

benzoyl chloride (98-88-4) + 10-carbon-sphingosine (235431-59-1) → N-((E)-(1S,2R)-2-Hydroxy-1-hydroxymethyl-non-3-enyl)-benzamide

Guidance literature:

benzoyl chloride; With pyridine; 1-methyl-pyrrolidin-2-one; p-OH-m-NO₂-C₆H₃-C(O)-resin; at 20 ℃;

10-carbon-sphingosine; In tetrahydrofuran; at 20 ℃;

DOI:10.1016/j.bmc.2005.01.027

Reference yield:

butyryl chloride (141-75-3) + 10-carbon-sphingosine (235431-59-1) → N-((E)-(1S,2R)-2-Hydroxy-1-hydroxymethyl-non-3-enyl)-butyramide (850264-01-6)

Guidance literature:

butyryl chloride; With pyridine; 1-methyl-pyrrolidin-2-one; p-OH-m-NO₂-C₆H₃-C(O)-resin; at 20 ℃;

10-carbon-sphingosine; In tetrahydrofuran; at 20 ℃;

DOI:10.1016/j.bmc.2005.01.027

upstream raw materials:

((E)-(1S,2R)-2-Hydroxy-1-hydroxymethyl-non-3-enyl)-carbamic acid tert-butyl ester

Downstream raw materials:

N-((E)-(1S,2R)-2-Hydroxy-1-hydroxymethyl-non-3-enyl)-butyramide