4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole

Base Information

Chemical Name:4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
CAS No.:157437-25-7
Molecular Formula:C8H6F2O3
Molecular Weight:188.13
Hs Code.:2932990090
European Community (EC) Number:824-958-1
DSSTox Substance ID:DTXSID801274672
Nikkaji Number:J1.878.332K
Mol file:157437-25-7.mol

Synonyms:157437-25-7;4-HYDROXYMETHYL-2,2-DIFLUORO-1,3-BENZODIOXOLE;(2,2-DIFLUORO-2H-1,3-BENZODIOXOL-4-YL)METHANOL;2,2-Difluoro-4-(hydroxymethyl)-1,3-benzodioxole;(2,2-DIFLUORO-1,3-BENZODIOXOL-4-YL)METHANOL;(2,2-Difluorobenzo[d][1,3]dioxol-4-yl)methanol;1,3-Benzodioxole-4-methanol, 2,2-difluoro-;MFCD06202698;2,2-Difluoro-1,3-benzodioxole-4-methanol;(2,2-DIFLUORO-BENZO[1,3]DIOXOL-4-YL)-METHANOL;SCHEMBL7651499;VHULACBMFYTQMM-UHFFFAOYSA-N;DTXSID801274672;AMY11793;AKOS006294228;PB27721;AS-33678;SY034295;CS-0053541;(2,2-difluoro-1,3-dioxaindan-4-yl)methanol;EN300-267670;F1911-3815

Suppliers and Price of 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole

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
Packaging
price

TRC
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
100mg
$ 45.00

SynQuest Laboratories
(2,2-Difluoro-1,3-benzodioxol-4-yl)methanol
250 mg
$ 49.00

SynQuest Laboratories
(2,2-Difluoro-1,3-benzodioxol-4-yl)methanol
1 g
$ 144.00

SynQuest Laboratories
(2,2-Difluoro-1,3-benzodioxol-4-yl)methanol
5 g
$ 485.00

Matrix Scientific
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
5g
$ 500.00

Matrix Scientific
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole
1g
$ 186.00

Crysdot
(2,2-Difluorobenzo[d][1,3]dioxol-4-yl)methanol 95+%
10g
$ 461.00

Chemenu
(2,2-difluorobenzo[d][1,3]dioxol-4-yl)methanol 95%
10g
$ 431.00

Apolloscientific
4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole 96%
1g
$ 130.00

American Custom Chemicals Corporation
4-HYDROXYMETHYL-2,2-DIFLUORO-1,3-BENZODIOXOLE 95.00%
5MG
$ 502.58

Total 17 raw suppliers

Chemical Property of 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole

Chemical Property:

Boiling Point:234.0±40.0 °C(Predicted)
PKA:14.24±0.10(Predicted)
PSA：38.69000
Density:1.51±0.1 g/cm3(Predicted)
LogP:1.50040
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:188.02850037
Heavy Atom Count:13
Complexity:198

Purity/Quality:

99%, ^*data from raw suppliers

4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C2C(=C1)OC(O2)(F)F)CO

Technology Process of 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole

There total 3 articles about 4-Hydroxymethyl-2,2-difluoro-1,3-benzodioxole 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: 95.0%

: 119895-68-0
2,2-difluoro-1,3-benzodioxol-4-yl-carbaldehyde

: 157437-25-7
(2,2-difluoro-1,3-benzodioxol-4-yl)methanol

Guidance literature:: With sodium tetrahydroborate; In methanol; at 0 ℃; for 0.25h;
DOI:10.1002/ejoc.200390079

Reference yield: 27.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 1583-59-1
2,2-difluoro-1,3-benzodioxole

: 157437-25-7
(2,2-difluoro-1,3-benzodioxol-4-yl)methanol

Guidance literature:: With sec.-butyllithium; In tetrahydrofuran; cyclohexane; at -75 ℃; for 3h;
DOI:10.1002/ejoc.200390079

Reference yield:

: 1583-59-1
2,2-difluoro-1,3-benzodioxole

: 157437-25-7
(2,2-difluoro-1,3-benzodioxol-4-yl)methanol

Guidance literature:: Multi-step reaction with 2 steps

1: 88 percent / sec-butyllithium / tetrahydrofuran; cyclohexane / -75 °C

2: 95 percent / sodium borohydride / methanol / 0.25 h / 0 °C

With sodium tetrahydroborate; sec.-butyllithium; In tetrahydrofuran; methanol; cyclohexane;
DOI:10.1002/ejoc.200390079