2-(Ethylsulfonyl)aniline

Base Information

Chemical Name:2-(Ethylsulfonyl)aniline
CAS No.:31596-87-9
Molecular Formula:C8H11NO2S
Molecular Weight:185.247
Hs Code.:2921420090
DSSTox Substance ID:DTXSID50505555
Wikidata:Q82360762
Mol file:31596-87-9.mol

Synonyms:2-(ethylsulfonyl)aniline;31596-87-9;2-ethylsulfonylaniline;Benzenamine, 2-(ethylsulfonyl)-;2-(Ethanesulfonyl)aniline;MFCD09945923;SCHEMBL1972988;AMY4678;DTXSID50505555;AKOS000190180;DS-11727;SY168624;EN300-35799;D84300;A911566;Z317047122

Suppliers and Price of 2-(Ethylsulfonyl)aniline

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

Crysdot
2-(Ethylsulfonyl)aniline 95+%
5g
$ 416.00

Crysdot
2-(Ethylsulfonyl)aniline 95+%
10g
$ 624.00

American Custom Chemicals Corporation
2-(ETHYLSULFONYL)ANILINE 95.00%
5G
$ 1421.65

American Custom Chemicals Corporation
2-(ETHYLSULFONYL)ANILINE 95.00%
2.5G
$ 1147.43

American Custom Chemicals Corporation
2-(ETHYLSULFONYL)ANILINE 95.00%
1G
$ 808.89

Ambeed
2-(Ethylsulfonyl)aniline 95+%
1g
$ 114.00

Ambeed
2-(Ethylsulfonyl)aniline 95+%
250mg
$ 57.00

Alichem
2-(Ethylsulfonyl)aniline
10g
$ 623.70

Alichem
2-(Ethylsulfonyl)aniline
5g
$ 415.80

Total 8 raw suppliers

Chemical Property of 2-(Ethylsulfonyl)aniline

Chemical Property:

Melting Point:74-75 °C
Boiling Point:382.1±34.0 °C(Predicted)
PKA:-0.90±0.10(Predicted)
PSA：68.54000
Density:1.234±0.06 g/cm3(Predicted)
LogP:2.72440
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:185.05104977
Heavy Atom Count:12
Complexity:230

Purity/Quality:

97% ^*data from raw suppliers

2-(Ethylsulfonyl)aniline 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCS(=O)(=O)C1=CC=CC=C1N

Technology Process of 2-(Ethylsulfonyl)aniline

There total 5 articles about 2-(Ethylsulfonyl)aniline 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: 94.5%

: 2976-33-2
Aethyl-(2-nitrophenyl)-sulfon

: 31596-87-9
Aethyl-(2-aminophenyl)-sulfon

Guidance literature:: With hydrogenchloride; iron; In ethanol; water; 1.) 75-80 deg C, 40 min 2.) reflux, 2 h;
DOI:10.1002/hlca.19800630610

Reference yield: 9.0%

: 109-99-9,24979-97-3,77392-70-2
tetrahydrofuran

: 93493-75-5
o-ethylsulphonylphenylazide

: 93-58-3,5705-52-2,80226-58-0
benzoic acid methyl ester

: 31596-87-9
Aethyl-(2-aminophenyl)-sulfon

: 93493-77-7
2-formylaminophenyl ethyl sulphone

Guidance literature:: With n-butyllithium; benzoic acid; In hexane; for 0.5h; Ambient temperature;
DOI:10.1016/S0040-4020(01)91123-8

Reference yield:

: 4875-10-9
o-nitrothiophenol

: 31596-87-9
Aethyl-(2-aminophenyl)-sulfon

Guidance literature:: Multi-step reaction with 3 steps

1: 85.8 percent / 1.) NaOH / ethanol / 1.) 15 min 2.) reflux, 14 h

2: 82 percent / H₂O₂ / acetic acid / 1.) below 80 deg C, 80 min 2.) reflux, 2 h

3: 94.5 percent / Fe powder, HCl / ethanol; H₂O / 1.) 75-80 deg C, 40 min 2.) reflux, 2 h

With hydrogenchloride; sodium hydroxide; dihydrogen peroxide; iron; In ethanol; water; acetic acid;
DOI:10.1002/hlca.19800630610