Guaiacolsulfonate

Guaiacolsulfonate
Clinical data
MedlinePlus	a606008
Pregnancy; category	IV, V, VI, VII, VIII -->;
ATC code	R05CA09 (WHO) ;
Identifiers
	IUPAC name 4-hydroxy-3-methoxy-benzenesulfonic acid;
CAS Number	50855-43-1 ;
PubChem CID	4874;
ChemSpider	4708 ;
UNII	713AJ00NPG;
ECHA InfoCard	100.051.625
Chemical and physical data
Formula	C7H8O5S
Molar mass	204.201 g/mol
3D model (JSmol)	Interactive image;
	SMILES Oc1cccc(c1OC)S([O-])(=O)=O;
	InChI InChI=1S/C7H8O5S/c1-12-7-5(8)3-2-4-6(7)13(9,10)11/h2-4,8H,1H3,(H,9,10,11)/p-1 ; Key:PSWOVMUIOCKEJX-UHFFFAOYSA-M ;
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Guaiacolsulfonate (also called sulfoguaiacolum) is an aromatic sulfonic acid used in medicine as an expectorant.^[1]

References

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Clinical data


MedlinePlus	a606008
Pregnancy category	IV, V, VI, VII, VIII -->
ATC code	R05CA09 (WHO)
Identifiers
IUPAC name 4-hydroxy-3-methoxy-benzenesulfonic acid
CAS Number	50855-43-1^Y
PubChem CID	4874
ChemSpider	4708^Y
UNII	713AJ00NPG
ECHA InfoCard	100.051.625
Chemical and physical data
Formula	C₇H₈O₅S
Molar mass	204.201 g/mol
3D model (JSmol)	Interactive image
SMILES Oc1cccc(c1OC)S([O-])(=O)=O
InChI InChI=1S/C7H8O5S/c1-12-7-5(8)3-2-4-6(7)13(9,10)11/h2-4,8H,1H3,(H,9,10,11)/p-1^Y Key:PSWOVMUIOCKEJX-UHFFFAOYSA-M^Y
(verify)