1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-

Base Information

Chemical Name:1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-
CAS No.:93578-48-4
Molecular Formula:C22H30O6
Molecular Weight:390.47000
Hs Code.:
NSC Number:157109
DSSTox Substance ID:DTXSID10303175
Wikidata:Q82048331

Synonyms:1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-;93578-48-4;NSC157109;SCHEMBL4072201;DTXSID10303175;NSC-157109

Suppliers and Price of 1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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Total 0 raw suppliers

Chemical Property of 1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-

Chemical Property:

PSA：77.38000
LogP:2.72320
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:390.20423867
Heavy Atom Count:28
Complexity:382

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)CC(CO)C(CC2=CC(=C(C=C2)OC)OC)CO)OC

Technology Process of 1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]-

There total 16 articles about 1,4-Butanediol, 2,3-bis[(3,4-dimethoxyphenyl)methyl]- 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: 80.0%

: 2-(3,4-Dimethoxy-benzyl)-3-(4-hydroxymethyl-3-methoxy-benzyl)-succinic acid dimethyl ester

: 93578-48-4
optically inactive 2,3-bis-(3,4-dimethoxy-benzyl)-butanediol-(1,4)

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; for 7h; Heating;

Reference yield: 57.0%

: 4773-01-7,25488-59-9,42207-62-5,42298-56-6,81446-31-3,93451-90-2,145514-52-9
(3R*,4R*)-3-(3,4-dimethoxybenzyl)-4-(3,4-dimethoxybenzyl)-4,5-dihydro-2(3H)-furanone

: 10352-25-7,58311-18-5,84893-70-9,93578-48-4,123877-50-9
(±)-secoisolariciresinol dimethyl ether

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 72h;
DOI:10.1016/S0040-4020(01)00025-4

Reference yield:

: 438581-68-1
1-(3,4-dimethoxyphenyl)-1-(3-(3,4-dimethoxyphenyl)-2-propenyloxy)-2,3-epoxypropane

: 10352-25-7,58311-18-5,84893-70-9,93578-48-4,123877-50-9
(±)-secoisolariciresinol dimethyl ether

Guidance literature:: Multi-step reaction with 2 steps

1.1: [Cp₂TiCl] / tetrahydrofuran / 60 °C

1.2: 90 percent / I₂ / tetrahydrofuran / 60 °C

2.1: 90 percent / H₂ / 10percent Pd/C / methanol / 3 h / 20 °C

With [Cp₂TiCl]; hydrogen; 10percent Pd/C; In tetrahydrofuran; methanol;
DOI:10.1021/jo010857u