Carpacin

Base Information

Chemical Name:Carpacin
CAS No.:194605-01-1
Molecular Formula:C11H12O3
Molecular Weight:192.214
Hs Code.:
UNII:Z52RCE6A8B
DSSTox Substance ID:DTXSID801027180
Metabolomics Workbench ID:70423
Wikidata:Q5045595
Wikipedia:Carpacin
Mol file:194605-01-1.mol

Synonyms:Carpacin;(E)-Carpacin;Carpacin, (E)-;194605-01-1;Z52RCE6A8B;1,3-Benzodioxole, 5-methoxy-6-(1E)-1-propenyl-;UNII-Z52RCE6A8B;C10435;5-Methoxy-6-(1-propen-1-yl)-1,3-benzodioxole;1,3-Benzodioxole, 5-methoxy-6-(1-propen-1-yl)-;5-methoxy-6-[(E)-prop-1-enyl]-1,3-benzodioxole;5-Methoxy-6-(1E)-1-propen-1-yl-1,3-benzodioxole;1,3-Benzodioxole, 5-methoxy-6-(1-propenyl)-, (E)-;1,3-Benzodioxole, 5-methoxy-6-(1E)-1-propen-1-yl-;AC1NQZ15;CHEBI:3432;DTXSID801027180;Q5045595;5-Methoxy-6-[(1E)-1-propen-1-yl]-1,3-benzodioxole

Suppliers and Price of Carpacin

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

Total 16 raw suppliers

Chemical Property of Carpacin

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:192.078644241
Heavy Atom Count:14
Complexity:215

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC=CC1=CC2=C(C=C1OC)OCO2
Isomeric SMILES:C/C=C/C1=CC2=C(C=C1OC)OCO2

Technology Process of Carpacin

There total 6 articles about Carpacin 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: 82.0%

: 5780-00-7
2-methoxy-4,5-methylenedioxybenzaldehyde

: 925-90-6
ethylmagnesium bromide

: 194605-01-1,23953-63-1
1,2-methylenedioxy-5-methoxy-4-trans-propenylbenzene

Guidance literature:: 2-methoxy-4,5-methylenedioxybenzaldehyde; ethylmagnesium bromide; In tetrahydrofuran; at 20 ℃; for 1h;

With sulfuric acid; In tetrahydrofuran; for 0.333333h; Heating;

Reference yield:

: 7228-35-5
5-methoxybenzo[d]1,3-dioxole

: 194605-01-1,23953-63-1
1,2-methylenedioxy-5-methoxy-4-trans-propenylbenzene

Guidance literature:: Multi-step reaction with 3 steps

1.1: 92 percent / NBS / CHCl₃

2.1: 90 percent / n-BuLi

3.1: tetrahydrofuran / 1 h / 20 °C

3.2: 82 percent / 5 N aq. H₂SO₄ / tetrahydrofuran / 0.33 h / Heating

With N-Bromosuccinimide; n-butyllithium; In tetrahydrofuran; chloroform;

Reference yield:

: 10022-35-2
1-bromo-2-methoxy-4,5-methylenedioxybenzene

: 194605-01-1,23953-63-1
1,2-methylenedioxy-5-methoxy-4-trans-propenylbenzene

Guidance literature:: Multi-step reaction with 2 steps

1.1: 90 percent / n-BuLi

2.1: tetrahydrofuran / 1 h / 20 °C

2.2: 82 percent / 5 N aq. H₂SO₄ / tetrahydrofuran / 0.33 h / Heating

With n-butyllithium; In tetrahydrofuran;