Phenyl(2-thienyl)methanol

Base Information

• Chemical Name: Phenyl(2-thienyl)methanol
• CAS No.: 26059-21-2
• Molecular Formula: C₁₁H₁₀OS
• Molecular Weight: 190.266
• DSSTox Substance ID: DTXSID90372405
• Nikkaji Number: J1.201.894K
• ChEMBL ID: CHEMBL4526562
• Mol file: 26059-21-2.mol

Synonyms:phenyl(2-thienyl)methanol;26059-21-2;phenyl(thiophen-2-yl)methanol;2-Thiophenemethanol, alpha-phenyl-;Maybridge1_007643;phenyl-2-thienyl-carbinol;phenyl (2-thienyl)methanol;phenyl-thiophen-2-yl-methanol;SCHEMBL477613;CHEMBL4526562;alpha-(2-Thienyl)benzyl alcohol;HMS563D09;DTXSID90372405;AASDNBSTNIJBFZ-UHFFFAOYSA-N;MFCD00277660;AKOS001835315;AKOS022301458;CCG-133703;FT-0693839

Chemical Property of Phenyl(2-thienyl)methanol

Chemical Property:

• Melting Point: 62℃
• PSA: 48.47000
• LogP: 2.82980
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 190.04523611
• Heavy Atom Count: 13
• Complexity: 154

Purity/Quality:

98%Min ^*data from raw suppliers

PHENYL(2-THIENYL)METHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CS2)O

Technology Process of Phenyl(2-thienyl)methanol

There total 43 articles about Phenyl(2-thienyl)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: 100.0%

2-Benzoylthiophene (135-00-2) → phenyl-thiophen-2-yl-methanol (26059-21-2,105748-50-3,118759-49-2)

Guidance literature:

With sodium tetrahydroborate; water; In tetrahydrofuran; for 3h; Heating / reflux;

Reference yield: 96.0%

thiophene-2-carbaldehyde (98-03-3) + phenylboronic acid (98-80-6) → phenyl-thiophen-2-yl-methanol (26059-21-2,105748-50-3,118759-49-2)

Guidance literature:

With C₆₂H₇₄Cl₂N₄Pd₂S₂; caesium carbonate; In 1,4-dioxane; at 70 ℃; for 3h; Inert atmosphere; Sealed tube;

DOI:10.1002/cctc.202001464

Reference yield: 95.0%

thiophene-2-carbaldehyde (98-03-3) + phenylboronic acid (98-80-6) → (R)-1-(2-thienyl)-phenyl-methanol (26059-21-2,105748-50-3,118759-49-2)

Guidance literature:

With [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; (R)-3-( tert-butyl)-4-(2,6-diphenoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole; potassium carbonate; In 1,4-dioxane; at 60 ℃; for 16h; enantioselective reaction; Inert atmosphere; Schlenk technique;

DOI:10.1021/jo400850m

upstream raw materials:

[2]thienyl sodium

benzaldehyde

2-Benzoylthiophene

thiophene

Downstream raw materials:

1,10-diphenyldecane

2-(methoxy(phenyl)methyl)thiophene

Carbamic acid phenyl-thiophen-2-yl-methyl ester

(R)-1-(2-thienyl)-phenyl-methanol