3-chlorosulfonylbenzoic acid

Names

[ Name ]:
3-chlorosulfonylbenzoic acid

[Synonym ]:
Benzoic acid, 3-(chlorosulfonyl)-
3-(Chlorosulfonyl)benzoic acid
MFCD00024877
EINECS 223-692-8
3-chlorosulfonylbenzoic acid

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
402.5±28.0 °C at 760 mmHg

[ Melting Point ]:
128-130 °C(lit.)

[ Molecular Formula ]:
C₇H₅ClO₄S

[ Molecular Weight ]:
220.630

[ Flash Point ]:
197.2±24.0 °C

[ Exact Mass ]:
219.959702

[ PSA ]:
79.82000

[ LogP ]:
2.06

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.588

MSDS

Safety Information

[ Symbol ]:

GHS05

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H314

[ Precautionary Statements ]:
P280-P305 + P351 + P338-P310

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges

[ Hazard Codes ]:
C:Corrosive;

[ Risk Phrases ]:
R22;R29;R34

[ Safety Phrases ]:
S26-S27-S36/37/39-S45

[ RIDADR ]:
UN 3261 8/PG 2

[ WGK Germany ]:
3

[ Packaging Group ]:
II

[ Hazard Class ]:
8

[ HS Code ]:
2916399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

benzoic acid
Chlorosulfonic acid
Benzoyl chloride
m-Carboxybenzenesulfonic acid
m-carboxybenzenediazonium chloride
Sulfur trioxide

DownStream

3-[(Methylamino)sulphonyl]benzoic Acid
3-(Chlorosulfonyl)benzoyl chloride
3-Cyanobenzenesulfonyl chloride
3-Sulfanylbenzoic acid
Benzenesulfonamide, 3-(hydroxymethyl)- (9CI)
N-benzyl-3-formylbenzenesulfonamide
3-(Phenylsulfonyl)benzoic acid
3-Cyanobenzenesulfonamide
3-(methylthio) benzoic acid
3-(Piperidin-1-ylsulfonyl)benzoic acid

Customs

[ HS Code ]: 2916399090

[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

Discovery of a novel class of PPARdelta partial agonists.

Bioorg. Med. Chem. Lett. 18 , 5018, (2008)

Anthranilic acid GW9371 was identified as a novel class of PPARdelta partial agonist through high-throughput screening. The design and synthesis of SAR analogues is described. GSK1115 and GSK7227 show...

4-bromo-3-chlorosulfonylbenzoic acid
4-Chloro-3-chlorosulfonylbenzoic acid
4-Isopropyl-3-chlorosulfonylbenzoic acid
3-chlorosulfonylbenzoic acid benzyl ester
2,6-dichloro-3-chlorosulfonylbenzoic acid
3-chlorosulfonylbenzoic acid 2-(toluene-4-sulfonyl)ethyl ester
2-(((2-(4-ethoxyphenyl)-5-methyloxazol-4-yl)methyl)thio)-3-(3-(2-oxopyrrolidin-1-yl)propyl)quinazolin-4(3H)-one
2-(((2-(3-chlorophenyl)-5-methyloxazol-4-yl)methyl)thio)-3-(3-(2-oxopyrrolidin-1-yl)propyl)quinazolin-4(3H)-one
3-cyclopentyl-2-(((5-methyl-2-(p-tolyl)oxazol-4-yl)methyl)thio)quinazolin-4(3H)-one
N-(2-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl)-2-oxo-2H-pyran-5-carboxamide
2-(((2-(4-chlorophenyl)-5-methyloxazol-4-yl)methyl)thio)-3-cyclopentylquinazolin-4(3H)-one
3-cyclopentyl-2-(((2-(4-ethoxy-3-methoxyphenyl)-5-methyloxazol-4-yl)methyl)thio)quinazolin-4(3H)-one
2-(((2-(5-bromo-2-methoxyphenyl)-5-methyloxazol-4-yl)methyl)thio)-3-cyclopentylquinazolin-4(3H)-one
3-cyclopentyl-2-(((5-methyl-2-(o-tolyl)oxazol-4-yl)methyl)thio)quinazolin-4(3H)-one
3-cyclopentyl-2-(((5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl)methyl)thio)quinazolin-4(3H)-one
6-Fluoro-1-methyl-7-(piperidin-1-yl)-3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-1,4-dihydroquinolin-4-one

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