3-Ethoxybenzenecarbothioamide

Base Information

Chemical Name:3-Ethoxybenzenecarbothioamide
CAS No.:747411-11-6
Molecular Formula:C₉H₁₁NOS
Molecular Weight:181.258
Hs Code.:
European Community (EC) Number:688-360-0
DSSTox Substance ID:DTXSID60366533
Wikidata:Q82151785
Mol file:747411-11-6.mol

Synonyms:747411-11-6;3-ethoxybenzenecarbothioamide;3-Ethoxythiobenzamide;3-ETHOXYBENZENE-1-CARBOTHIOAMIDE;3-Ethoxybenzothioamide;SCHEMBL7899218;DTXSID60366533;3-Ethoxythiobenzamide, AldrichCPR;MFCD05270860;AKOS000203161;NCGC00334820-01;CS-0299472;FT-0733415;EN300-09494;AB01327502-02;Z56979299

Suppliers and Price of 3-Ethoxybenzenecarbothioamide

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-Ethoxythiobenzamide Aldrich
1g
$ 194.00

Crysdot
3-Ethoxybenzothioamide 97%
10g
$ 494.00

American Custom Chemicals Corporation
3-ETHOXYBENZENECARBOTHIOAMIDE 95.00%
5G
$ 1143.68

American Custom Chemicals Corporation
3-ETHOXYBENZENECARBOTHIOAMIDE 95.00%
1G
$ 707.02

Alfa Aesar
3-Ethoxythiobenzamide, 97%
5g
$ 428.00

Alfa Aesar
3-Ethoxythiobenzamide, 97%
1g
$ 97.20

Total 8 raw suppliers

Chemical Property of 3-Ethoxybenzenecarbothioamide

Chemical Property:

Vapor Pressure:0.000546mmHg at 25°C
Refractive Index:1.602
Boiling Point:311.9°C at 760 mmHg
Flash Point:142.5°C
PSA：67.34000
Density:1.158g/cm³
LogP:2.41980
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:181.05613515
Heavy Atom Count:12
Complexity:161

Purity/Quality:

99% ^*data from raw suppliers

3-Ethoxythiobenzamide Aldrich ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC=CC(=C1)C(=S)N

Technology Process of 3-Ethoxybenzenecarbothioamide

There total 2 articles about 3-Ethoxybenzenecarbothioamide 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:

: 25117-75-3
3-(ethyloxy)benzonitrile

: 747411-11-6
3-ethoxy-thiobenzoic acid amide

Guidance literature:: With ethanol; hydrogen sulfide; ammonia; Erhitzen des erhaltenen Reaktionsgemisches im geschlossenen Gefaess auf 105grad;
DOI:10.1021/ja01306a048

Reference yield:

: 621-33-0
m-phenetidine

: 747411-11-6
3-ethoxy-thiobenzoic acid amide

Guidance literature:: Multi-step reaction with 2 steps

1: sodium nitrite; aqueous hydrochloric acid / Eintragen der Diazoniumsalz-Loesung in eine warme, aus Kupfer(II)-sulfat, Kaliumcyanid und wss. Ammoniak (oder Wasser) hergestellte Loesung

2: ethanol; ammonia; hydrogen sulfide / Erhitzen des erhaltenen Reaktionsgemisches im geschlossenen Gefaess auf 105grad

With hydrogenchloride; ethanol; hydrogen sulfide; ammonia; sodium nitrite;
DOI:10.1021/ja01306a048