1,2,3-Hexanetriol, (2R,3S)-rel-

Base Information

• Chemical Name: 1,2,3-Hexanetriol, (2R,3S)-rel-
• CAS No.: 130855-55-9
• Molecular Formula: C6H14O3
• Molecular Weight: 134.175
• UNII: XN0FZU1U8V,65A8B0NSL4
• Nikkaji Number: J344.092C
• Mol file: 130855-55-9.mol

Synonyms:(2R,3S)-hexane-1,2,3-triol;UNII-65A8B0NSL4;1,2,3-Hexanetriol, (2R,3S)-rel-;65A8B0NSL4;1,2,3-Hexanetriol, (R,S)-(+/-)-;1,2,3-Hexanetriol, (2R,3S)-(+/-)-;UNII-XN0FZU1U8V;XN0FZU1U8V;1,2,3-Hexanetriol, (2R,3S)-;1,2,3-Hexanetriol, (2R,3S)-(+)-;83134-92-3;130855-55-9;1,2,3-trihydroxyhexane;UNII-S2K8GDK6KP;S2K8GDK6KP;SCHEMBL9199211

Chemical Property of 1,2,3-Hexanetriol, (2R,3S)-rel-

Chemical Property:

• XLogP3: -0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 134.094294304
• Heavy Atom Count: 9
• Complexity: 65.3

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC(C(CO)O)O
• Isomeric SMILES: CCC[C@@H]([C@@H](CO)O)O

Technology Process of 1,2,3-Hexanetriol, (2R,3S)-rel-

There total 1 articles about 1,2,3-Hexanetriol, (2R,3S)-rel- 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:

(2R,3R)-2,3-epoxy-1-hexanol (92418-71-8) → (2R,3S)-hexane-1,2,3-triol (130855-55-9) + (2S,3R)-hexane-1,2,3-triol (95839-99-9)

Guidance literature:

With sulfuric acid; In methanol; chloroform; at 20 ℃; for 7h; Title compound not separated from byproducts;

DOI:10.1055/s-2006-956488

Reference yield:

(2R,3S)-hexane-1,2,3-triol (130855-55-9) + (R)-methoxyphenylacetic acid (3966-32-3) → tris-(R)-α-methoxy-α-phenylacetic acid ester of (2R,3S)-hexane-1,2,3-triol

Guidance literature:

With dmap; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In dichloromethane; at 20 ℃;

DOI:10.1021/ol0616135

Reference yield:

(2R,3S)-hexane-1,2,3-triol (130855-55-9) + (S)-2-methoxy-2-phenylacetic acid (26164-26-1) → tris-(S)-α-methoxy-α-phenylacetic acid ester of (2R,3S)-hexane-1,2,3-triol

Guidance literature:

With dmap; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In dichloromethane; at 20 ℃;

DOI:10.1021/ol0616135

upstream raw materials:

(2R,3R)-2,3-epoxy-1-hexanol

Refernces