Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester

Base Information

Chemical Name:Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester
CAS No.:226934-92-5
Molecular Formula:C₁₂H₁₄O₅
Molecular Weight:238.24
Hs Code.:
DSSTox Substance ID:DTXSID101242965
Nikkaji Number:J1.927.672D

Synonyms:DTXSID101242965;1,2,3-Propanetriol, 1-acetate 2-benzoate, (2R)-;Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester;226934-92-5

Suppliers and Price of Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester

Supply Marketing:

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

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Chemical Property of Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester

Chemical Property:

XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:238.08412354
Heavy Atom Count:17
Complexity:258

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)OCC(CO)OC(=O)C1=CC=CC=C1
Isomeric SMILES:CC(=O)OC[C@@H](CO)OC(=O)C1=CC=CC=C1

Technology Process of Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester

There total 6 articles about Benzoic acid (R)-1-(hydroxymethyl)-2-acetoxyethyl ester 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: 92.0%

: 88753-45-1
(R)-1-acetoxy-2-benzoyloxy-3-benzyloxypropane

: 226934-92-5
(R)-3-acetoxy-2-benzoyloxypropan-1-ol

Guidance literature:: With hydrogen; 10percent Pd/C; In isopropyl alcohol; at 20 ℃; for 1h;
DOI:10.1002/adsc.200303027

Reference yield: 63.0%

: 108-05-4,9003-20-7
vinyl acetate

: 3376-49-6
2-benzoyloxypropane-1,3-diol

: 226934-92-5
(R)-3-acetoxy-2-benzoyloxypropan-1-ol

Guidance literature:: With Porcine Pancreas Lipase; In hexane; at 20 ℃; for 1h; Heating;
DOI:10.1002/adsc.200303027

Reference yield:

: 98-88-4
benzoyl chloride

: 226934-92-5
(R)-3-acetoxy-2-benzoyloxypropan-1-ol

Guidance literature:: Multi-step reaction with 2 steps

1: 75 percent / Et₃N; 4-(N,N-dimethylamino)pyridine / CH₂Cl₂ / 3 h / Heating

2: 92 percent / H₂ / 10percent Pd/C / propan-2-ol / 1 h / 20 °C

With dmap; hydrogen; triethylamine; 10percent Pd/C; In dichloromethane; isopropyl alcohol;
DOI:10.1002/adsc.200303027