4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one

Base Information

Chemical Name:4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one
CAS No.:862888-12-8
Molecular Formula:C₁₃H₁₂O₃
Molecular Weight:216.236
Hs Code.:
DSSTox Substance ID:DTXSID001267083
Nikkaji Number:J2.194.697D

Synonyms:DTXSID001267083;862888-12-8;4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one

Suppliers and Price of 4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:216.078644241
Heavy Atom Count:16
Complexity:300

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(C=CC1=O)COC(=O)C2=CC=CC=C2

Technology Process of 4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one

There total 5 articles about 4-[(Benzoyloxy)methyl]-2-cyclopenten-1-one 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: 63.0%

: 862888-13-9
trans,trans-benzoic acid 4-oxo-6-(trimethylsilanyl)-hexa-2,5-dienyl ester

: 862888-12-8
benzoic acid 4-oxo-cyclopent-2-enylmethyl ester

: 97367-33-4
4-methylene-2-cyclopenten-1-one

Guidance literature:: With boron trifluoride diethyl etherate; In benzene; Heating;
DOI:10.1081/SCC-200061633

Reference yield:

: 862888-29-7
trans,trans-benzoic acid 4-hydroxy-6-(trimethylsilanyl)-hexa-2,5-dienyl ester

: 862888-12-8
benzoic acid 4-oxo-cyclopent-2-enylmethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 99 percent / DDQ / dioxane / 24 h / 20 °C

2: 63 percent / BF₃*Et₂O / benzene / Heating

With boron trifluoride diethyl etherate; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In 1,4-dioxane; benzene; 2: Nazarov cyclization;
DOI:10.1081/SCC-200061633

Reference yield:

: 81121-63-3
4‐hydroxybut‐2‐en‐1‐yl benzoate

: 862888-12-8
benzoic acid 4-oxo-cyclopent-2-enylmethyl ester

Guidance literature:: Multi-step reaction with 4 steps

1.1: 51 percent / PCC; molecular sieves / CH₂Cl₂ / 2 h / 20 °C

2.1: Mg / tetrahydrofuran / 1 h / Heating

2.2: 74 percent / -43 - 25 °C

3.1: 99 percent / DDQ / dioxane / 24 h / 20 °C

4.1: 63 percent / BF₃*Et₂O / benzene / Heating

With molecular sieve; boron trifluoride diethyl etherate; magnesium; pyridinium chlorochromate; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In tetrahydrofuran; 1,4-dioxane; dichloromethane; benzene; 4.1: Nazarov cyclization;
DOI:10.1081/SCC-200061633