Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-

Base Information

Chemical Name:Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-
CAS No.:346611-59-4
Molecular Formula:C12H15NO4S
Molecular Weight:269.321
Hs Code.:
DSSTox Substance ID:DTXSID80405791
Wikidata:Q82210499
Mol file:346611-59-4.mol

Synonyms:346611-59-4;2-(4-(Pyrrolidin-1-ylsulfonyl)phenyl)acetic acid;Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-;Oprea1_829031;SCHEMBL2517123;DTXSID80405791;NUNOXVLMHNUAGQ-UHFFFAOYSA-N;2-[4-(pyrrolidine-1-sulfonyl)phenyl]acetic acid;EN300-1456909;[4-(Pyrrolidine-1-sulfonyl)-phenyl]-acetic acid;A1-48337

Suppliers and Price of Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-

Supply Marketing:

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

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Chemical Property of Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-

Chemical Property:

XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:269.07217913
Heavy Atom Count:18
Complexity:387

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)O

Technology Process of Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)-

There total 3 articles about Benzeneacetic acid, 4-(1-pyrrolidinylsulfonyl)- 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: 98.0%

: 1152315-21-3
[4-(pyrrolidine-1-sulfonyl)-phenyl]-acetic acid ethyl ester

: 346611-59-4
4-(1-pyrrolidine)sulfonylphenylacetic acid

Guidance literature:: [4-(pyrrolidine-1-sulfonyl)-phenyl]-acetic acid ethyl ester; With methanol; sodium hydroxide; at 20 ℃; for 1.5h;

With hydrogenchloride; In water;

Reference yield:

: 101-97-3
Ethyl 2-phenylethanoate

: 346611-59-4
4-(1-pyrrolidine)sulfonylphenylacetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: chlorosulfonic acid / 0.5 h / 20 - 40 °C

2: triethylamine / tetrahydrofuran / 1 h / 0 - 20 °C

3: sodium hydroxide; methanol / 1.5 h / 20 °C

With methanol; chlorosulfonic acid; triethylamine; sodium hydroxide; In tetrahydrofuran;

Reference yield:

: 87202-52-6
(4-chlorosulfonyl-phenyl)acetic acid ethyl ester

: 346611-59-4
4-(1-pyrrolidine)sulfonylphenylacetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / tetrahydrofuran / 1 h / 0 - 20 °C

2: sodium hydroxide; methanol / 1.5 h / 20 °C

With methanol; triethylamine; sodium hydroxide; In tetrahydrofuran;