2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide

Base Information

Chemical Name:2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide
CAS No.:107788-08-9
Molecular Formula:C₁₉H₁₈N₂O₄S
Molecular Weight:370.429
Hs Code.:
Wikidata:Q76388878
ChEMBL ID:CHEMBL483233
Mol file:107788-08-9.mol

Synonyms:CHEMBL483233;2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide;2-Propenamide, 2-cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-;107788-08-9;BDBM50292516;LS-123330;2-cyano-3-(3-ethoxy-4-hydroxy-5-((4-hydroxyphenylthio)methyl)phenyl)acrylamide

Suppliers and Price of 2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide

Chemical Property:

Vapor Pressure:2.45E-18mmHg at 25°C
Boiling Point:665.8°Cat760mmHg
Flash Point:356.5°C
Density:1.39g/cm³
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:370.09872823
Heavy Atom Count:26
Complexity:551

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC(=CC(=C1O)CSC2=CC=C(C=C2)O)C=C(C#N)C(=O)N
Isomeric SMILES:CCOC1=CC(=CC(=C1O)CSC2=CC=C(C=C2)O)/C=C(\C#N)/C(=O)N

Technology Process of 2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide

There total 4 articles about 2-Cyano-3-(3-ethoxy-4-hydroxy-5-(((4-hydroxyphenyl)thio)methyl)phenyl)-2-propenamide 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: 51.0%

: 107788-27-2
3-Ethoxy-4-hydroxy-5-(4-hydroxy-phenylsulfanylmethyl)-benzaldehyde

: 107-91-5
cyanoacetic acid amide

: 107788-08-9
(E)-2-Cyano-3-[3-ethoxy-4-hydroxy-5-(4-hydroxy-phenylsulfanylmethyl)-phenyl]-acrylamide

Guidance literature:: With piperidine; acetic acid; In benzene; for 5h; Heating;
DOI:10.1248/cpb.36.974

Reference yield:

: 121-32-4
4-hydroxy-3-ethoxybenzaldehyde

: 107788-08-9
(E)-2-Cyano-3-[3-ethoxy-4-hydroxy-5-(4-hydroxy-phenylsulfanylmethyl)-phenyl]-acrylamide

Guidance literature:: Multi-step reaction with 3 steps

1: SnCl₄ / 2 h / Ambient temperature

2: Et₃N / CHCl₃ / 2 h / Ambient temperature

3: 51 percent / piperidine, acetic acid / benzene / 5 h / Heating

With piperidine; tin(IV) chloride; acetic acid; triethylamine; In chloroform; benzene;
DOI:10.1248/cpb.36.974

Reference yield:

: 637-89-8
4-sulfanylphenol

: 107788-08-9
(E)-2-Cyano-3-[3-ethoxy-4-hydroxy-5-(4-hydroxy-phenylsulfanylmethyl)-phenyl]-acrylamide

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N / CHCl₃ / 2 h / Ambient temperature

2: 51 percent / piperidine, acetic acid / benzene / 5 h / Heating

With piperidine; acetic acid; triethylamine; In chloroform; benzene;
DOI:10.1248/cpb.36.974