[(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol

Base Information

• Chemical Name: [(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol
• CAS No.: 54445-64-6
• Molecular Formula: C6H12O2
• Molecular Weight: 116.16
• Hs Code.: 2906199090
• European Community (EC) Number: 887-318-0
• Nikkaji Number: J38.984F
• Mol file: 54445-64-6.mol

Synonyms:54445-64-6;[(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol;Cyclobutane-1beta,2beta-dimethanol;[(1R,2S)-2-(hydroxymethyl)cyclobutyl]methanol;((1R,2S)-Cyclobutane-1,2-diyl)dimethanol;CIS-1,2-BIS-HYDROXYMETHYL-CYCLOBUTANE;SCHEMBL8344810;MFCD09866668;AKOS024436753;AS-61911;CS-0129397;W19717;(1R,2S)-CYCLOBUTANE-1,2-DIYLDIMETHANOL;EN300-6740674;rel-((1R,2S)-Cyclobutane-1,2-diyl)dimethanol

Chemical Property of [(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol

Chemical Property:

• PSA: 40.46000
• LogP: -0.00280
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 116.083729621
• Heavy Atom Count: 8
• Complexity: 62.9

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(C1CO)CO
• Isomeric SMILES: C1C[C@H]([C@H]1CO)CO

Technology Process of [(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol

There total 11 articles about [(1S,2R)-2-(hydroxymethyl)cyclobutyl]methanol 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: 90.0%

(+/-)-(1S,2S)-cyclobutane-1,2-dicarboxylic acid (1124-13-6,1461-94-5,3396-14-3,17224-72-5,58616-94-7,58616-97-0) → trans-(cyclobutane-1,2-diyl)dimethanol (7371-64-4,54445-64-6,55659-54-6,82442-57-7,82442-58-8,5140-07-8)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 25 ℃; Inert atmosphere;

Reference yield: 89.0%

cis-1,2-cyclobutane dicarboxylic anhydride (4462-96-8) → (1R,2S)-(2-hydroxymethylcyclobutyl)methanol (54445-64-6)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 - 50 ℃; for 18h; Inert atmosphere;

Reference yield: 88.0%

dimethyl trans-1,2-cyclobutane dicarboxylate (7371-67-7) → trans-(cyclobutane-1,2-diyl)dimethanol (7371-64-4,54445-64-6,55659-54-6,82442-57-7,82442-58-8,5140-07-8)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran;

DOI:10.1021/ja00381a024

upstream raw materials:

cis-1,2-cyclobutane dicarboxylic anhydride

3-oxabicyclo[3.2.0]heptane-2,4-dione

diethyl trans-1,2-cyclobutanedicarboxylate

trans-1,2-dicyanocyclobutane

Downstream raw materials:

cis-1,2-Bis<(tosyloxy)methyl>cyclobutane

(-)-(1R,2R)-1,2-bis(hydroxymethyl)cyclobutane

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