CHEBI:18312 - 4-(hydroxymethyl)benzenesulfonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-(hydroxymethyl)benzenesulfonic acid
ChEBI ID CHEBI:18312
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1937, CHEBI:20298
Supplier Information
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Formula C7H8O4S
Net Charge 0
Average Mass 188.20202
Monoisotopic Mass 188.01433
InChI InChI=1S/C7H8O4S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4,8H,5H2,(H,9,10,11)
InChIKey VVQVMHASNBSOOC-UHFFFAOYSA-N
SMILES OCc1ccc(cc1)S(O)(=O)=O
ChEBI Ontology
Outgoing 4-(hydroxymethyl)benzenesulfonic acid (CHEBI:18312) is a arenesulfonic acid (CHEBI:33555)
4-(hydroxymethyl)benzenesulfonic acid (CHEBI:18312) is conjugate acid of 4-(hydroxymethyl)benzenesulfonate (CHEBI:11944)
Incoming 4-(hydroxymethyl)benzenesulfonate (CHEBI:11944) is conjugate base of 4-(hydroxymethyl)benzenesulfonic acid (CHEBI:18312)
IUPAC Name
4-(hydroxymethyl)benzenesulfonic acid
Synonyms Sources
4-(Hydroxymethyl)benzenesulfonate KEGG COMPOUND
4-Sulfobenzyl alcohol KEGG COMPOUND
Manual Xref Database
C06678 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
3605659 Beilstein Registry Number Beilstein
561215 Gmelin Registry Number Gmelin
Last Modified
13 April 2007