CID 160594

Base Information

Chemical Name:CID 160594
CAS No.:1782-55-4
Molecular Formula:C10H10 O5
Molecular Weight:210.186
Hs Code.:2918990090
DSSTox Substance ID:DTXSID901030502
Wikidata:Q27109313,Q105347894
Mol file:1782-55-4.mol

Synonyms:SCHEMBL197850;DTXSID901030502;Q27109313

Suppliers and Price of CID 160594

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

Sigma-Aldrich
3,4-Dihydroxy-5-methoxycinnamic acid ≥95.0% (HPLC)
10mg
$ 208.00

Sigma-Aldrich
3,4-Dihydroxy-5-methoxycinnamic acid ≥95.0% (HPLC)
50mg
$ 814.00

American Custom Chemicals Corporation
3,4-DIHYDROXY-5-METHOXYCINNAMIC ACID 95.00%
5MG
$ 501.37

Adipogen Life Sciences
5-Hydroxyferulicacid ≥95%(HPLC)
10 mg
$ 94.00

Total 14 raw suppliers

Chemical Property of CID 160594

Chemical Property:

Vapor Pressure:7.49E-09mmHg at 25°C
Melting Point:168-170 °C
Boiling Point:449.1°Cat760mmHg
PKA:4.53±0.10(Predicted)
Flash Point:182.8°C
PSA：86.99000
Density:1.44g/cm³
LogP:1.20420
XLogP3:1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:210.05282342
Heavy Atom Count:15
Complexity:250

Purity/Quality:

97% ^*data from raw suppliers

3,4-Dihydroxy-5-methoxycinnamic acid ≥95.0% (HPLC) ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1O)O)C=CC(=O)O

Technology Process of CID 160594

There total 7 articles about CID 160594 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: 94.0%

: 141-82-2
malonic acid

: 3934-87-0
5-hydroxyvanillin

: 1782-55-4
3-(4,5-dihydroxy-3-methoxyphenyl)prop-2-enoic acid

Guidance literature:: malonic acid; 5-hydroxyvanillin; With pyridine; at 55 ℃;

With piperidine; aniline; at 20 ℃;
DOI:10.1016/S0045-2068(03)00042-7

Reference yield: 30.0%

: 77-78-1
dimethyl sulfate

: 6093-59-0,709007-50-1
3,4,5‐trihydroxycinnamic acid

: 1782-55-4
3-(4,5-dihydroxy-3-methoxyphenyl)prop-2-enoic acid

Guidance literature:: With borax; sodium hydroxide; sodium tetraborate; In water; at 20 ℃;
DOI:10.1016/S0045-2068(03)00042-7

Reference yield: 10.4%

: 530-59-6,7362-37-0
sinapinic acid

: 1782-55-4
3-(4,5-dihydroxy-3-methoxyphenyl)prop-2-enoic acid

: 6093-59-0,709007-50-1
3,4,5‐trihydroxycinnamic acid

Guidance literature:: sinapinic acid; With boron tribromide; In dichloromethane; at -78 - 20 ℃; for 24h;

With hydrogenchloride; In dichloromethane; at 20 ℃; for 2h;
DOI:10.1002/ptr.6060