alpha-Fluorocinnamic acid

Base Information Edit

Chemical Name:alpha-Fluorocinnamic acid
CAS No.:350-90-3
Molecular Formula:C9H7FO2
Molecular Weight:166.152
Hs Code.:2916399090
European Community (EC) Number:206-508-0,640-505-9
NSC Number:102780
UNII:FGR8LT33FT
Nikkaji Number:J386.921K,J48.461J
Wikidata:Q27454816
ChEMBL ID:CHEMBL4064181
Mol file:350-90-3.mol

Synonyms:alpha-Fluorocinnamic acid;350-90-3;20397-61-9;(2Z)-2-fluoro-3-phenylprop-2-enoic acid;2-Propenoic acid, 2-fluoro-3-phenyl-;.alpha.-Fluorocinnamic acid;Cinnamic acid, alpha-fluoro-;2-Fluoro-3-phenylpropenoic acid;(Z)-2-fluoro-3-phenylprop-2-enoic acid;(Z)-2-Fluoro-3-phenylacrylic acid;2-Fluoro-3-phenyl-2-propenoic acid;(Z)-alpha-Fluorocinnamic acid;2-fluoro-3-phenylacrylic acid;EINECS 206-508-0;FGR8LT33FT;2-Propenoic acid, 2-fluoro-3-phenyl-, (2Z)-;NSC 102780;BRN 2501318;trans-alpha-Fluorocinnamic acid;Cinnamic acid, .alpha.-fluoro-;(2Z)-2-Fluoro-3-phenylacrylic acid;NSC-102780;(2Z)-2-Fluoro-3-phenyl-2-propenoic acid;1-09-00-00237 (Beilstein Handbook Reference);MFCD00004222;WLN: QVYFU1R;UNII-FGR8LT33FT;alpha -Fluorocinnamic acid;a-FLUOROCINNAMIC ACID;alpha-FLUORO CINNAMIC ACID;alpha-Fluorocinnamic acid, 98%;CHEMBL4064181;QONCEXMULRJPPY-VURMDHGXSA-;Z-2-fluoro-3-phenylpropenoic acid;NSC102780;AKOS005255389;LS-54105;CS-0269704;(2Z)-2-Fluoro-3-phenyl-2-propenoic acid #;EN300-376285;A822528;J-019864;Q27454816

Suppliers and Price of alpha-Fluorocinnamic acid

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
α-Fluorocinnamic acid 98%
5g
$ 256.00

Sigma-Aldrich
α-Fluorocinnamic acid 98%
1g
$ 69.70

American Custom Chemicals Corporation
ALPHA-FLUOROCINNAMIC ACID 95.00%
5G
$ 1069.65

American Custom Chemicals Corporation
ALPHA-FLUOROCINNAMIC ACID 95.00%
1G
$ 677.20

AK Scientific
alpha-Fluorocinnamicacid
2.5g
$ 344.00

Total 20 raw suppliers

Chemical Property of alpha-Fluorocinnamic acid Edit

Chemical Property:

Appearance/Colour:Solid
Vapor Pressure:0.00103mmHg at 25°C
Melting Point:156-159 °C(lit.)
Refractive Index:1.585
Boiling Point:289.3 °C at 760 mmHg
PKA:2.25±0.10(Predicted)
Flash Point:128.7 °C
PSA：37.30000
Density:1.275 g/cm³
LogP:2.08160
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:166.04300762
Heavy Atom Count:12
Complexity:193

Purity/Quality:

98%,99%, ^*data from raw suppliers

α-Fluorocinnamic acid 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

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)C=C(C(=O)O)F
Isomeric SMILES:C1=CC=C(C=C1)/C=C(/C(=O)O)\F
Uses α-?Fluorocinnamic Acid is a reagent used in the biosynthesis of Coumarin (C755380), a pharmaceutic aid (flavor) that is found in tonka beans, levender oil, woodruff, sweet clover.

Technology Process of alpha-Fluorocinnamic acid

There total 10 articles about alpha-Fluorocinnamic 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: 96.5%