Trimethylolpropane monoallyl ether

Base Information Edit

Chemical Name:Trimethylolpropane monoallyl ether
CAS No.:682-11-1
Deprecated CAS:133177-06-7,30112-65-3,30112-65-3
Molecular Formula:C9H18 O3
Molecular Weight:174.24
Hs Code.:2909499000
European Community (EC) Number:211-662-7
UNII:112W61CL04
DSSTox Substance ID:DTXSID5052674
Nikkaji Number:J25.070H
Wikidata:Q27251216
Mol file:682-11-1.mol

Synonyms:Trimethylolpropane monoallyl ether;682-11-1;2-Allyloxymethyl-2-ethylpropanediol;1,1,1-Trimethylolpropane monoallyl ether;EINECS 211-662-7;2-ethyl-2-(prop-2-enoxymethyl)propane-1,3-diol;BRN 1854856;AI3-26933;UNII-112W61CL04;1-Butanol, 2,2-(dihydroxymethyl)-, monoallyl ether;112W61CL04;1,3-Propanediol, 2-ethyl-2-((2-propenyloxy)methyl)-;TRIMETHYLOL PROPANE MONOALLYL ETHER;EC 211-662-7;ETHER, ALLYL (2,2-BIS(HYDROXYMETHYL)BUTYL);1,1,1-(TRIHYDROXYMETHYL)PROPANE MONOALLYL ETHER;1,3-Propanediol, 2-ethyl-2-[(2-propenyloxy)methyl]-;1,3-Propanediol, 2-ethyl-2-((2-propen-1-yloxy)methyl)-;Trimethylolpropane allyl ether;TRIMETHYLOLPROPANEMONOALLYLETHER;SCHEMBL111075;DTXSID5052674;Trimethylol propanemonoallyl ether;Trimethylolpropane Mono Allyl Ether;MFCD00046753;Trimethylolpropane allyl ether, 98%;LS-67712;2-(allyloxymethyl)-2-ethylpropane-1,3-diol;FT-0707696;1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-;W-109592;Q27251216

Suppliers and Price of Trimethylolpropane monoallyl ether

Supply Marketing:Edit

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

Sigma-Aldrich
Trimethylolpropane allyl ether 98%
500ml
$ 67.80

American Custom Chemicals Corporation
TRIMETHYLOLPROPANE MONOALLYL ETHER 95.00%
5MG
$ 501.19

Total 16 raw suppliers

Chemical Property of Trimethylolpropane monoallyl ether Edit

Chemical Property:

Vapor Pressure:0.035Pa at 25℃
Melting Point:-10 °C
Refractive Index:n20/D 1.467(lit.)
Boiling Point:160 °C33 mm Hg(lit.)
PKA:14.25±0.10(Predicted)
Flash Point:>230 °F
PSA：49.69000
Density:1.01 g/mL at 25oC(lit.)
LogP:0.57000
Water Solubility.:10g/L at 20℃
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:174.125594432
Heavy Atom Count:12
Complexity:119

Purity/Quality:

99.9% ^*data from raw suppliers

Trimethylolpropane allyl ether 98% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(CO)(CO)COCC=C

Technology Process of Trimethylolpropane monoallyl ether

There total 4 articles about Trimethylolpropane monoallyl ether 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%

: 107388-12-5
5-ethyl-5-[(allyloxy)methyl]-2,2-dimethyl-1,3-dioxane

: 682-11-1
trimethylol propane monoallyl ether

Guidance literature:: With sulfuric acid; at 60 ℃; for 8h;
DOI:10.1134/S1070427215100079

Reference yield:

: 20761-68-6
1,3-dioxa-5-ethyl-2,2-dimethyl-5-cyclohexylmethanol

: 682-11-1
trimethylol propane monoallyl ether

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydroxide / toluene / 8 h / 30 °C

2: sulfuric acid / 8 h / 60 °C

With sulfuric acid; sodium hydroxide; In toluene;
DOI:10.1134/S1070427215100079