4-[(Dimethylamino)sulfonyl]benzoic acid
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![4-[(Dimethylamino)sulfonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2fee5f373abb4acc9f30425cf391a8e2.png "4-[(Dimethylamino)sulfonyl]benzoic acid")
4-[(Dimethylamino)sulfonyl]benzoic acid
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CAS No:
1206-37-7
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Formula:
C9H11NO4S
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Chemical Name:
4-[(Dimethylamino)sulfonyl]benzoic acid
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Synonyms:
Benzoic acid,4-[(dimethylamino)sulfonyl]-;Benzoic acid,p-(dimethylsulfamoyl)-;4-[(Dimethylamino)sulfonyl]benzoic acid;4-Carboxy-N,N-dimethylbenzenesulfonamide;p-Dimethylsulfamoylbenzoic acid;4-[(N,N-Dimethylamino)sulfonyl]benzoic acid;4-Dimethylsulfamoylbenzoic acid
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CAS No:
Characteristics
83.06000
1.71590
1.368g/cm3
249-250 °C @ Solvent: Water
397.3ºC at 760mmHg
194.1ºC
1.57
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:229.26
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:229.04087901
Monoisotopic Mass:229.04087901
Topological Polar Surface Area:83.1
Heavy Atom Count:15
Complexity:323
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-[(Dimethylamino)sulfonyl]benzoic acid
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