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(Q82444403)
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English
4-(Methanesulfonyl)-2-methoxybenzoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
230.02489442
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₀O₅S
0 references
canonical SMILES
COC1=C(C=CC(=C1)S(=O)(=O)C)C(=O)O
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Identifiers
InChI
InChI=1S/C9H10O5S/c1-14-8-5-6(15(2,12)13)3-4-7(8)9(10)11/h3-5H,1-2H3,(H,10,11)
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InChIKey
NEQFNMHWZNGLFO-UHFFFAOYSA-N
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CAS Registry Number
114086-41-8
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PubChem CID
14478169
1 reference
matched by identifier from
InChIKey
InChIKey
NEQFNMHWZNGLFO-UHFFFAOYSA-N
UniChem compound ID
42487547
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10560802
1 reference
matched by identifier from
InChIKey
InChIKey
NEQFNMHWZNGLFO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00511580
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