2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic acid

Base Information

Chemical Name:2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic acid
CAS No.:20168-99-4
Molecular Formula:C21H19 N O4
Molecular Weight:349.386
Hs Code.:2933990090
DSSTox Substance ID:DTXSID70878556
Mol file:20168-99-4.mol

Synonyms:DTXSID70878556

Suppliers and Price of 2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic acid

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

American Custom Chemicals Corporation
CINMETACIN 95.00%
5MG
$ 496.20

Total 15 raw suppliers

Chemical Property of 2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic acid

Chemical Property:

Vapor Pressure:2.45E-10mmHg at 25°C
Melting Point:170-172°; mp 164-165°
Refractive Index:1.5614 (estimate)
Boiling Point:488°Cat760mmHg
PKA:4.00±0.30(Predicted)
Flash Point:248.9°C
PSA：68.53000
Density:1.19g/cm³
LogP:3.93900
Water Solubility.:<1mg/L(25 oC)
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:349.13140809
Heavy Atom Count:26
Complexity:540

Purity/Quality:

99% ^*data from raw suppliers

CINMETACIN 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=C(N1C(=O)C=CC3=CC=CC=C3)C=CC(=C2)OC)CC(=O)O
Therapeutic Function Antiinflammatory

Technology Process of 2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic acid

There total 1 articles about 2-[5-Methoxy-2-methyl-1-(3-phenylprop-2-enoyl)indol-3-yl]acetic 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:

: 20168-99-4
cinmetacine

Guidance literature:: Aus N-(p-Methoxy-phenyl)-N-cinnamoyl-hydrazin u. Laevulinsaeure;
DOI:10.1021/jm00301a050

Reference yield:

: 20168-99-4
cinmetacine

: 2882-15-7
5-Methoxy-2-methylindole-3-acetic acid

: 4151-45-5
cinnamate ion

Guidance literature:: With sodium hydroxide; In acetonitrile; at 25 ℃; Rate constant;
DOI:10.1002/jps.2600720928

Reference yield:

: 20168-99-4
cinmetacine

: 21604-99-9
1-(3-Phenylpropionyl)-2-methyl-5-methoxy-3-indolessigsaeure

: C₁₂H₁₃NO₃*C₄H₁₂N⁽¹⁺⁾*Cl^(1-)

Guidance literature:: With tetramethlyammonium chloride; In ethanol; electrolysis at a controlled potential; mercury working electrode; graphite as the auxiliary electrode;
DOI:10.1007/BF01148386