4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid

Base Information

• Chemical Name: 4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid
• CAS No.: 152191-47-4
• Molecular Formula: C₂₂H₁₈O₃
• Molecular Weight: 330.383
• DSSTox Substance ID: DTXSID801132535

Synonyms:DTXSID801132535;4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid;152191-47-4

Chemical Property of 4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 330.125594432
• Heavy Atom Count: 25
• Complexity: 591

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C34C5C6C3C7C4C5C67C(=O)O)O

Technology Process of 4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid

There total 1 articles about 4-(Hydroxydiphenylmethyl)pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid 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%

methyl 4-(α,α-diphenylhydroxymethyl)pentacyclo<4.2.0.02,5.03,8.04,7>octane-1-carboxylate (156205-14-0) → 4-(α,α-diphenylhydroxymethyl)pentacyclo<4.2.0.02,5.03,8.04,7>octane-1-carboxylic acid (152191-47-4)

Guidance literature:

With sodium hydroxide; In methanol; for 1h; Heating;

DOI:10.1248/cpb.41.1760

Reference yield:

N-<3-<3-(1-piperidinylmethyl)phenoxy>propyl>amine (73278-98-5) + 4-(α,α-diphenylhydroxymethyl)pentacyclo<4.2.0.02,5.03,8.04,7>octane-1-carboxylic acid (152191-47-4) → 4-(Hydroxy-diphenyl-methyl)-cubane-1-carboxylic acid [3-(3-piperidin-1-ylmethyl-phenoxy)-propyl]-amide

Guidance literature:

With triethylamine; Yield given. Multistep reaction; 2.) CH₂Cl₂, RT, 1 h;

DOI:10.1248/cpb.41.1760

upstream raw materials:

methyl 4-(α,α-diphenylhydroxymethyl)pentacyclo<4.2.0.0^2,5.0^3,8.0^4,7>octane-1-carboxylate

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