2-Methyl-3-phenyl-2-propenal

Base Information

Chemical Name:2-Methyl-3-phenyl-2-propenal
CAS No.:66051-14-7
Molecular Formula:C₁₀H₁₀O
Molecular Weight:146.189
Hs Code.:
European Community (EC) Number:202-938-8
NSC Number:49286,22283
UN Number:1993
UNII:16G5N27XPA
DSSTox Substance ID:DTXSID301018368
Nikkaji Number:J3.569.486B
Wikidata:Q27162210
Metabolomics Workbench ID:44957
ChEMBL ID:CHEMBL1594090

Synonyms:alpha-Methyl cinnamaldehyde;Methyl cinnamic aldehyde;66051-14-7;3-Phenyl-2-methylacrolein;(Z)-2-methyl-3-phenylprop-2-enal;2-Methyl-3-phenyl-2-propenal;alpha-Methylcinnamic aldehyde;2-Propenal, 2-methyl-3-phenyl-, (2Z)-;2-Methyl-3-phenylacrolein;(Z)-2-methyl-3-phenylacrylaldehyde;2-Propenal, 2-methyl-3-phenyl-;101-39-3;16G5N27XPA;CHEBI:89992;Cinnamaldehyde, alpha-methyl;alpha-Methylcinnimal;2-Propenal, 2-methyl-3-phenyl-, (Z)-;WLN: VHYU1R;Cinnamaldehyde, alpha-methyl-;CCRIS 6257;EINECS 202-938-8;BRN 0507514;.alpha.-Methylcinnimal;a - methylcinnamaldehyde;AI3-26230;Z-alpha-Methylcinnamaldehyde;.alpha.-Methylcinnamaldehyde;.alpha.-Methylcinnamic aldehyde;2-Propenal, 2-metil-3-fenil-;cyprinal;starbld0031159;a-Methylcinnamaldehyde, 8CI;UNII-16G5N27XPA;cis-alpha-Methylcinnamaldehyde;alpha-methyl cinnamic aldehyde;MLS002454385;SCHEMBL891311;(Z)-alpha-methylcinnamaldehyde;Alpha Methyl Cinnamic Aldehyde;CHEMBL1594090;FEMA 2697;alpha-Methylcinnamaldehyde, (Z)-;VLUMOWNVWOXZAU-CLFYSBASSA-N;DTXSID301018368;HMS3039F05;NSC22283;NSC49286;LS-330;Z-.ALPHA.-METHYLCINNAMALDEHYDE;(2Z)-2-Methyl-3-phenyl-2-propenal;(2Z)-2-methyl-3-phenylprop-2-enal;AKOS017278308;CIS-.ALPHA.-METHYLCINNAMALDEHYDE;NCGC00091690-01;SMR001372002;(Z)-2-Methyl-3-phenyl-2-propene-1-one;.ALPHA.-METHYLCINNAMALDEHYDE, (Z)-;J3.569.486B;Q27162210

Suppliers and Price of 2-Methyl-3-phenyl-2-propenal

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
(2Z)-2-Methyl-3-phenyl-2-propenal
500mg
$ 130.00

TRC
(2Z)-2-Methyl-3-phenyl-2-propenal
100mg
$ 40.00

Total 6 raw suppliers

Chemical Property of 2-Methyl-3-phenyl-2-propenal

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:146.073164938
Heavy Atom Count:11
Complexity:152
Transport DOT Label:Combustible Liquid

Purity/Quality:

99% ^*data from raw suppliers

(2Z)-2-Methyl-3-phenyl-2-propenal ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=CC1=CC=CC=C1)C=O
Isomeric SMILES:C/C(=C/C1=CC=CC=C1)/C=O
Uses (2Z)-2-Methyl-3-phenyl-2-propenal (Epalrestat Impurity 2) is an impurity of Epalrestat (E565300), an aldose reductase inhibitor used to treat diabetic neuropathy.

Technology Process of 2-Methyl-3-phenyl-2-propenal

There total 7 articles about 2-Methyl-3-phenyl-2-propenal 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: 53.0%

: 1504-55-8
2-methyl-3-phenylprop-2-en-1-ol

: 66051-14-7
(Z)-α-methyl-cinnamaldehyde

: 15174-47-7
α-methyl-trans-cinnamaldehyde

Guidance literature:: With manganese(IV) oxide; In hexane; at 20 ℃; for 20h;
DOI:10.1039/c4cc00310a

Reference yield: 35.0%

: 78-85-3,25120-30-3
2-methylpropenal

: 71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1
benzene

: 838-87-9
α-benzyl-cinnamaldehyde

: 30457-88-6
2-benzyl-2-propenal

: 66051-14-7
(Z)-α-methyl-cinnamaldehyde

: 15174-47-7
α-methyl-trans-cinnamaldehyde

Guidance literature:: With oxygen; sodium acetate; acetylacetone; palladium diacetate; In propionic acid; at 90 ℃; for 1.5h; under 760.051 Torr;
DOI:10.1021/jo050534o

Reference yield:

: 7042-33-3,7042-34-4,1734-78-7
ethyl 2-methylcinnamate

: 66051-14-7
(Z)-α-methyl-cinnamaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: diisobutylaluminium hydride / tetrahydrofuran; hexane / 3 h / -78 °C

2: manganese(IV) oxide / hexane / 20 h / 20 °C

With manganese(IV) oxide; diisobutylaluminium hydride; In tetrahydrofuran; hexane;
DOI:10.1039/c4cc00310a