4-[Benzyl(methyl)sulfamoyl]benzoic acid

Base Information

Chemical Name:4-[Benzyl(methyl)sulfamoyl]benzoic acid
CAS No.:887202-40-6
Molecular Formula:C₁₅H₁₅NO₄S
Molecular Weight:305.354
Hs Code.:2935009090
European Community (EC) Number:863-636-5
DSSTox Substance ID:DTXSID80365922
Wikidata:Q82150963
Mol file:887202-40-6.mol

Synonyms:887202-40-6;4-[benzyl(methyl)sulfamoyl]benzoic acid;4-(N-benzyl-N-methylsulfamoyl)benzoic acid;4-{[BENZYL(METHYL)AMINO]SULFONYL}BENZOIC ACID;4-([benzyl(methyl)amino]sulfonyl)benzoic acid;TRANS-3-HEXENOICACID;SCHEMBL1614968;DTXSID80365922;OSFGNTLIOUHOKN-UHFFFAOYSA-N;BBL003991;MFCD04440788;STK803589;AKOS005173928;VS-01471;4-(N-benzyl-N-methylsulfamoyl)benzoicacid;FT-0683629;EN300-237639;F1386-0344

Suppliers and Price of 4-[Benzyl(methyl)sulfamoyl]benzoic 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

TRC
4-{[Benzyl(methyl)amino]sulfonyl}benzoicAcid
500mg
$ 155.00

Matrix Scientific
4-{[Benzyl(methyl)amino]sulfonyl}benzoic acid
500mg
$ 158.00

Crysdot
4-(N-Benzyl-N-methylsulfamoyl)benzoicacid 95+%
5g
$ 527.00

American Custom Chemicals Corporation
4-([BENZYL(METHYL)AMINO]SULFONYL)BENZOIC ACID 95.00%
1G
$ 693.00

American Custom Chemicals Corporation
4-([BENZYL(METHYL)AMINO]SULFONYL)BENZOIC ACID 95.00%
0.5G
$ 638.00

Alichem
4-(N-Benzyl-N-methylsulfamoyl)benzoicacid
5g
$ 579.88

AK Scientific
4-{[Benzyl(methyl)amino]sulfonyl}benzoicacid
500mg
$ 263.00

Total 3 raw suppliers

Chemical Property of 4-[Benzyl(methyl)sulfamoyl]benzoic acid

Chemical Property:

PSA：83.06000
LogP:3.28630
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:305.07217913
Heavy Atom Count:21
Complexity:443

Purity/Quality:

97% ^*data from raw suppliers

4-{[Benzyl(methyl)amino]sulfonyl}benzoicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O

Technology Process of 4-[Benzyl(methyl)sulfamoyl]benzoic acid

There total 1 articles about 4-[Benzyl(methyl)sulfamoyl]benzoic 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:

: 10130-89-9
p-carboxyphenylsulfonyl chloride

: 64-04-0
phenethylamine

: 887202-40-6
4-(N-benzyl-N-methylsulfamoyl)benzoic acid

Guidance literature:: With triethylamine; In methanol; at 0 - 20 ℃; for 24h;

Reference yield:

: 887202-40-6
4-(N-benzyl-N-methylsulfamoyl)benzoic acid

: 3-ethyl-1-(3-hydroxy-2,2-dimethylpropyl)spiro[6,8-dihydro-5H-pyrazolo[4,3-c]azepine-7,4’-tetrahydropyran]-4-one

: [3-(3-ethyl-4-oxospiro[6,8-dihydro-5H-pyrazolo[4,3-c]azepine-7,4’-tetrahydropyran]-1-yl)-2,2-dimethylpropyl] 4-(methylsulfamoyl)benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / acetonitrile / 18 h / 20 °C

2: methanesulfonic acid / 3 h / 80 °C

With dmap; methanesulfonic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In acetonitrile;