Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:64455 - benzenesulfonic acid
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
benzenesulfonic acid
ChEBI ID
CHEBI:64455
Definition
The simplest member of the class of a benzenesulfonic acids that consists of a benzene carrying a single sulfo group.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Wikipedia
License
Read full article at Wikipedia
Formula
C6H6O3S
Net Charge
0
Average Mass
158.17500
Monoisotopic Mass
158.00377
InChI
InChI=1S/C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)
InChIKey
SRSXLGNVWSONIS-UHFFFAOYSA-N
SMILES
OS(=O)(=O)c1ccccc1
ChEBI Ontology
Outgoing
benzenesulfonic acid (
CHEBI:64455
)
is a
benzenesulfonic acids (
CHEBI:73942
)
benzenesulfonic acid (
CHEBI:64455
)
is conjugate acid of
benzenesulfonate (
CHEBI:64457
)
Incoming
benzenesulfonate ester (
CHEBI:83352
)
has functional parent
benzenesulfonic acid (
CHEBI:64455
)
benzenesulfonate (
CHEBI:64457
)
is conjugate base of
benzenesulfonic acid (
CHEBI:64455
)
Synonyms
Sources
Benzene sulphonic acid
ChemIDplus
Benzenemonosulfonic acid
ChemIDplus
Benzenesulphonic acid
ChemIDplus
Besylic acid
ChemIDplus
Phenylsulfonic acid
ChemIDplus
Manual Xref
Database
Benzenesulfonic acid
Wikipedia
View more database links
Registry Numbers
Types
Sources
742513
Reaxys Registry Number
Reaxys
98-11-3
CAS Registry Number
ChemIDplus
Last Modified
20 October 2014