CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL-

Base Information

• Chemical Name: CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL-
• CAS No.: 4663-36-9
• Molecular Formula: C21H18O
• Molecular Weight: 286.373
• NSC Number: 78810
• Nikkaji Number: J48.473C,J2.472.180I
• Wikidata: Q76323608
• Mol file: 4663-36-9.mol

Synonyms:4663-36-9;CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL-;alpha,alpha-Diphenylcinnamyl alcohol;NSC 78810;2-Propen-1-ol, 1,1,3-triphenyl-;AI3-18964;Benzenemethanol, alpha-phenyl-alpha-(2-phenylethenyl)-;Benzenemethanol, .alpha.-phenyl-.alpha.-(2-phenylethenyl)-;NSC78810;WLN: QXR&R&1U1R;alpha-[(E)-Styryl]benzhydrol;SCHEMBL4630824;2-Propen-1-ol,1,3-triphenyl-;1,1,3-triphenyl-2-propen-1-ol;Cinnamyl alcohol,.alpha.-diphenyl-;NSC-78810;STK366743;(2E)-1,1,3-triphenylprop-2-en-1-ol;(E)-1,1,3-triphenyl-prop-2-en-1-ol;LS-54242

Chemical Property of CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL-

Chemical Property:

• Vapor Pressure: 2.2E-09mmHg at 25°C
• Boiling Point: 463.4°C at 760 mmHg
• Flash Point: 184.5°C
• PSA: 20.23000
• Density: 1.133g/cm³
• LogP: 4.63590
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 286.135765193
• Heavy Atom Count: 22
• Complexity: 323

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CC(C2=CC=CC=C2)(C3=CC=CC=C3)O
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/C(C2=CC=CC=C2)(C3=CC=CC=C3)O

Technology Process of CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL-

There total 15 articles about CINNAMYL ALCOHOL, alpha,alpha-DIPHENYL- 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: 99.0%

(E)-1,1,3-Triphenyl-3-phenyltellanyl-prop-2-en-1-ol → 1,1,3-triphenylprop-2-en-1-ol (4663-36-9)

Guidance literature:

With n-butyllithium; In tetrahydrofuran; hexane; at -72 - 0 ℃; for 0.5h;

DOI:10.1021/ol050114l

Reference yield: 81.0%

phenylmagnesium bromide + benzalacetophenone (94-41-7) → 1,3,3-triphenylpropan-1-one (606-86-0) + 1,1,3-triphenylprop-2-en-1-ol (4663-36-9)

Guidance literature:

With cerium(III) chloride; In tetrahydrofuran; at 0 ℃; for 1h;

DOI:10.1016/S0040-4039(00)94945-1

Reference yield: 62.0%

phenylytterbium iodide (26138-28-3) + benzalacetophenone (94-41-7) → 1,1,3-triphenylprop-2-en-1-ol (4663-36-9)

Guidance literature:

In tetrahydrofuran; Ambient temperature;

DOI:10.1021/jo00392a006

upstream raw materials:

benzophenone

diethyl ether

1,1,3,-triphenyl-1-propene

ethyl 3-phenyl-2-propenoate

Downstream raw materials:

1-methoxy-1-1.3t-triphenyl-propene-⁽²⁾

hexa-1,5-diene-1,1,3,4,6,6-hexaylhexabenzene

3-chloro-1,1,3-triphenyl-propene

1,3-diphenylindene

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