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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5O5S.H4N
Molecular Weight 219.215
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ammonium 2-sulfobenzoate

SMILES

[NH4+].OC(=O)C1=CC=CC=C1S([O-])(=O)=O

InChI

InChIKey=PJGXSCHDOCZUNR-UHFFFAOYSA-N
InChI=1S/C7H6O5S.H3N/c8-7(9)5-3-1-2-4-6(5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);1H3

HIDE SMILES / InChI

Molecular Formula H4N
Molecular Weight 18.0385
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H5O5S
Molecular Weight 201.177
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Pharmacokinetics and pharmacodynamics of dexamethasone sodium-m-sulfobenzoate (DS) after intravenous and intramuscular administration: a comparison with dexamethasone phosphate (DP).
2001 Apr
Synthesis of protected L-4-[sulfono(difluoromethyl)phenylalanine and its incorporation into a peptide.
2001 May 17
Structural confirmation of ostreocin-D by application of negative-ion fast-atom bombardment collision-induced dissociation tandem mass spectrometric methods.
2002
Surface ATRP of hydrophilic monomers from ultrafine aqueous silica sols using anionic polyelectrolytic macroinitiators.
2007 Jan 16
Facile Synthesis and Polymerization of 2,6-Difluoro-2'-sulfobenzophenone for Aromatic Proton Conducting Ionomers with Pendant Sulfobenzoyl Groups.
2010 Aug 3
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:51:27 GMT 2023
Edited
by admin
on Fri Dec 15 18:51:27 GMT 2023
Record UNII
YDE5SHF3ZK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ammonium 2-sulfobenzoate
Systematic Name English
Ammonium o-sulfobenzoic acid
Systematic Name English
Benzoic acid, o-sulfo-, S-monoammonium salt
Common Name English
Benzoic acid, 2-sulfo-, ammonium salt (1:1)
Systematic Name English
Benzoic acid, 2-sulfo-, monoammonium salt
Systematic Name English
Ammonium o-sulfobenzoate
Systematic Name English
2-Sulfobenzoic Acid Monoammonium Salt
Common Name English
NSC-38710
Code English
Ammonium o-carboxybenzenesulfonate
Systematic Name English
Code System Code Type Description
CAS
6939-89-5
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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EPA CompTox
DTXSID60884303
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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FDA UNII
YDE5SHF3ZK
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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PUBCHEM
81360
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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NSC
38710
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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ECHA (EC/EINECS)
230-077-8
Created by admin on Fri Dec 15 18:51:27 GMT 2023 , Edited by admin on Fri Dec 15 18:51:27 GMT 2023
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