4-(hydroxymethyl)dihydrofuran-2(3H)-one

Base Information

• Chemical Name: 4-(hydroxymethyl)dihydrofuran-2(3H)-one
• CAS No.: 36679-81-9
• Molecular Formula: C5H8O3
• Molecular Weight: 116.117
• European Community (EC) Number: 897-773-7
• Nikkaji Number: J2.147.399E
• Mol file: 36679-81-9.mol

Synonyms:36679-81-9;4-(hydroxymethyl)dihydrofuran-2(3H)-one;4-(hydroxymethyl)oxolan-2-one;Dihydro-4-(hydroxymethyl)furan-2(3H)-one;4-Hydroxymethyl-dihydro-furan-2-one;3-hydroxymethyl-4-butanolide;SCHEMBL963415;PVQRPRXBBGDUMX-UHFFFAOYSA-;PVQRPRXBBGDUMX-UHFFFAOYSA-N;MFCD21099409;4-(hydroxymethyl)dihydro-furan-2-one;AKOS023600229;SB36853;AM806516;AS-39774;CS-0037642;FT-0763043;2(3H)-Furanone, dihydro-4-(hydroxymethyl)-;EN300-332096;A1-12217;F2147-2093;InChI=1/C5H8O3/c6-2-4-1-5(7)8-3-4/h4,6H,1-3H2

Chemical Property of 4-(hydroxymethyl)dihydrofuran-2(3H)-one

Chemical Property:

• PSA: 46.53000
• LogP: -0.45820
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 116.047344113
• Heavy Atom Count: 8
• Complexity: 99.8

Purity/Quality:

97% ^*data from raw suppliers

Dihydro-4-(hydroxymethyl)furan-2(3H)-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(COC1=O)CO

Technology Process of 4-(hydroxymethyl)dihydrofuran-2(3H)-one

There total 15 articles about 4-(hydroxymethyl)dihydrofuran-2(3H)-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: 99.0%

4-hydroxymethyl-5H-furan-2-one (80904-75-2) → 4-hydroxymethyl-1,2,3,4-tetrahydrofuran-2-one (36679-81-9)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; at 20 ℃; for 4h; atmospheric pressure;

DOI:10.1021/jo040193z

Reference yield: 92.0%

paraconic acid (498-89-5) → 4-hydroxymethyl-1,2,3,4-tetrahydrofuran-2-one (36679-81-9)

Guidance literature:

With dimethylsulfide borane complex; In tetrahydrofuran; at 0 - 5 ℃; for 3h;

DOI:10.1016/0040-4020(82)85019-9

Reference yield: 71.0%

(rel)-(1S/1R,3S)-(tetrahydro-1-methoxyfuran-3-yl)methanol (143724-42-9) → 4-hydroxymethyl-1,2,3,4-tetrahydrofuran-2-one (36679-81-9)

Guidance literature:

With boron trifluoride diethyl etherate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane; for 3h; Ambient temperature;

upstream raw materials:

4-butanolide

methanol

paraconic acid

(rel)-(1S/1R,3S)-(tetrahydro-1-methoxyfuran-3-yl)methanol

Downstream raw materials:

4-(4-Methoxy-benzyloxy-methyl)-tetrahydrofuran-2-one

(±)-4-[(benzyloxy)methyl]-dihydrofuran-2(3H)-one

(+/-)-4-(tert-butyldiphenylsilyloxymethyl)-4H,5H-dihydrofuran-2-one

3-(tert-butyldimethylsilyloxymethyl)-4-(2-phenylimidazol-1-yl)butanamide