(Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic acid

Base Information

Chemical Name:(Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic acid
CAS No.:5740-35-2
Molecular Formula:C₁₀H₁₀O₃S
Molecular Weight:210.254
Hs Code.:
NSC Number:108817
Nikkaji Number:J3.041.746A,J227.984C
ChEMBL ID:CHEMBL4129039
Mol file:5740-35-2.mol

Synonyms:CHEMBL4129039;(Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic acid;2-Mercapto-3-(4-methoxyphenyl)acrylic acid;93515-30-1;5740-35-2;NSC108817;SCHEMBL17651848;SCHEMBL17651849;BDBM50271915;AKOS000273958;NSC-108817;(Z)-2-Mercapto-3-(4-methoxyphenyl)acrylic acid;(2Z)-2-mercapto-3-(4-methoxyphenyl)acrylic acid;SR-01000404293;SR-01000404293-1

Suppliers and Price of (Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic 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
(2E)-3-(4-METHOXYPHENYL)-2-SULFANYLPROP-2-ENOIC ACID 95.00%
5MG
$ 499.00

Total 6 raw suppliers

Chemical Property of (Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic acid

Chemical Property:

Vapor Pressure:7.45E-07mmHg at 25°C
Boiling Point:392.2°Cat760mmHg
Flash Point:191°C
PSA：85.33000
Density:1.29g/cm³
LogP:2.05050
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:210.03506535
Heavy Atom Count:14
Complexity:230

Purity/Quality:

99% ^*data from raw suppliers

(2E)-3-(4-METHOXYPHENYL)-2-SULFANYLPROP-2-ENOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C=C(C(=O)O)S
Isomeric SMILES:COC1=CC=C(C=C1)/C=C(/C(=O)O)\S

Technology Process of (Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic acid

There total 11 articles about (Z)-3-(4-methoxyphenyl)-2-sulfanylprop-2-enoic 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: 81.0%

: (5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(4-methylpiperazin-1-yl)acetamide

: 93515-30-1,5740-35-2
3-(4-methoxyphenyl)-2-sulfanylpropenoic acid

Guidance literature:: (5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(4-methylpiperazin-1-yl)acetamide; With sodium hydroxide; at 60 ℃; for 0.75h;

With hydrogenchloride; In water;
DOI:10.1016/j.bmc.2018.02.043

Reference yield: 67.0%

: 5462-97-5,81154-16-7
5-(4-methoxybenzylidene)-2-thioxo-4-thiazolidinone

: 93515-30-1,5740-35-2
3-(4-methoxyphenyl)-2-sulfanylpropenoic acid

Guidance literature:: 5-(4-methoxybenzylidene)-2-thioxo-4-thiazolidinone; With sodium hydroxide;

With hydrogenchloride;
DOI:10.1039/b501309g

Reference yield:

: 1261158-91-1
(Z)-2-(5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid

: 93515-30-1,5740-35-2
3-(4-methoxyphenyl)-2-sulfanylpropenoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: bis-(2-oxo-3-oxazolidinyl)phosphoryl chloride; triethylamine / dichloromethane / 0.5 h / 0 °C

1.2: 20 °C

2.1: sodium hydroxide / 0.75 h / 60 °C

With bis-(2-oxo-3-oxazolidinyl)phosphoryl chloride; triethylamine; sodium hydroxide; In dichloromethane;
DOI:10.1016/j.bmc.2018.02.043