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3-methoxybenzenesulfonic acid
chemical compound
3-Methoxybenzenesulfonic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
methoxybenzenesulfonic acids
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chemical structure
3-Methoxybenzenesulfonic acid.svg
438 × 398; 9 KB
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mass
188.014329736
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₈O₄S
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canonical SMILES
COC1=CC(=CC=C1)S(=O)(=O)O
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Identifiers
InChI
InChI=1S/C7H8O4S/c1-11-6-3-2-4-7(5-6)12(8,9)10/h2-5H,1H3,(H,8,9,10)
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InChIKey
CDZWHCZLBLCDFR-UHFFFAOYSA-N
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CAS Registry Number
34256-01-4
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PubChem CID
12037036
1 reference
matched by identifier from
InChIKey
InChIKey
CDZWHCZLBLCDFR-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL669998
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CDZWHCZLBLCDFR-UHFFFAOYSA-N
UniChem compound ID
25508936
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00476302
1 reference
matched by identifier from
InChIKey
InChIKey
CDZWHCZLBLCDFR-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00427112
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