2-(Propan-2-yl)but-2-enoic acid

Base Information

Chemical Name:2-(Propan-2-yl)but-2-enoic acid
CAS No.:94773-28-1
Molecular Formula:C7H12O2
Molecular Weight:128.171
Hs Code.:
DSSTox Substance ID:DTXSID40708316

Synonyms:94773-28-1;2-(Propan-2-yl)but-2-enoic acid;DTXSID40708316;2-methylpent-3-ene-3-carboxylic acid

Suppliers and Price of 2-(Propan-2-yl)but-2-enoic acid

Supply Marketing:

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

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Chemical Property of 2-(Propan-2-yl)but-2-enoic acid

Chemical Property:

PSA：37.30000
LogP:1.67330
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:128.083729621
Heavy Atom Count:9
Complexity:134

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC=C(C(C)C)C(=O)O

Technology Process of 2-(Propan-2-yl)but-2-enoic acid

There total 1 articles about 2-(Propan-2-yl)but-2-enoic acid 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: 46.0%

: 591-50-4
iodobenzene

: (Z)-2-isopropyl-3-trimethylsilyl-2-butenoic acid

: 94773-28-1
(E)-2-(1-methylethyl)-2-butenoic acid

: (Z)-2-isopropyl-3-phenyl-2-butenoic acid

Guidance literature:: With caesium carbonate; tris(dibenzylideneacetone)dipalladium⁽⁰⁾ chloroform complex; In 1,2-dimethoxyethane; at 60 ℃; for 22h;
DOI:10.1055/s-2004-836033

Reference yield: 85.0%

: 94773-28-1
trans-α-isopropylcrotonic acid

: 23944-47-0
(+/-)-trachelanthic acid

Guidance literature:: With osmium(VIII) oxide; chloric acid;
DOI:10.1021/jm00383a001

Reference yield:

: 94773-28-1
trans-α-isopropylcrotonic acid

: 41708-76-3
(+)-indicine N-oxide

Guidance literature:: Multi-step reaction with 6 steps

1: 85 percent / OsO₄, HClO₃

3: conc. aq. HCl / 1.5 h / 25 °C

4: 1.) N,N'-carbonyldiimidazole (CDI), 2.) imidazoylsodium / 1.) DMF, 15 min, 2.) DMF, 25 deg C, 24 h

5: 0.6 N aq. HCl / 24 h / 25 °C

6: m-chloroperbenzoic acid / CHCl₃ / 0.33 h / Ambient temperature

With hydrogenchloride; osmium(VIII) oxide; chloric acid; imidazolyl sodium; 3-chloro-benzenecarboperoxoic acid; 1,1'-carbonyldiimidazole; In chloroform;
DOI:10.1021/jm00383a001