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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:61958 - butane-1-sulfonic acid
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ChEBI Name
butane-1-sulfonic acid
ChEBI ID
CHEBI:61958
Definition
An alkanesulfonic acid in which the alkyl group directly linked to the sulfo functionality is butyl.
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This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C4H10O3S
Net Charge
0
Average Mass
138.187
Monoisotopic Mass
138.03507
InChI
InChI=1S/C4H10O3S/c1-2-3-4-8(5,6)7/h2-4H2,1H3,(H,5,6,7)
InChIKey
QDHFHIQKOVNCNC-UHFFFAOYSA-N
SMILES
C(CCS(O)(=O)=O)C
ChEBI Ontology
Outgoing
butane-1-sulfonic acid (
CHEBI:61958
)
is a
alkanesulfonic acid (
CHEBI:47901
)
butane-1-sulfonic acid (
CHEBI:61958
)
is conjugate acid of
butane-1-sulfonate (
CHEBI:61911
)
Incoming
butane-1-sulfonate (
CHEBI:61911
)
is conjugate base of
butane-1-sulfonic acid (
CHEBI:61958
)
Synonyms
Sources
1-Butanesulfonic acid
ChemIDplus
butane sulfonic acid
ChEBI
Butane-1-sulphonic acid
ChemIDplus
butanesulfonic acid
ChEBI
n-butane sulfonic acid
ChEBI
n-butane-1-sulfonic acid
ChEBI
n-butanesulphonic acid
ChEBI
Registry Numbers
Types
Sources
1749086
Reaxys Registry Number
Reaxys
2386-47-2
CAS Registry Number
ChemIDplus
Last Modified
06 July 2016