CHEBI:191380 - 2,4-dimethylphenyl hydrogen sulfate

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ChEBI Name 2,4-dimethylphenyl hydrogen sulfate ChEBI ID CHEBI:191380 Definition An aryl sulfate that is 2,4-xylenol in which the phenolic hydrogen has been replaced by a sulfo group. Stars This entity has been manually annotated by the ChEBI Team. Submitter Mark Williams Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H10O4S Net Charge 0 Average Mass 202.220 Monoisotopic Mass 202.02998 InChI InChI=1S/C8H10O4S/c1-6-3-4-8(7(2)5-6)12-13(9,10)11/h3-5H,1-2H3,(H,9,10,11) InChIKey APHMMCXRJZOPMO-UHFFFAOYSA-N SMILES CC1=CC(C)=C(OS(O)(=O)=O)C=C1 ChEBI Ontology Outgoing 2,4-dimethylphenyl hydrogen sulfate (CHEBI:191380) has functional parent 2,4-xylenol (CHEBI:34241) 2,4-dimethylphenyl hydrogen sulfate (CHEBI:191380) is a aryl sulfate (CHEBI:37919) IUPAC Name 2,4-dimethylphenyl hydrogen sulfate Synonyms Sources (2,4-dimethylphenyl) hydrogen sulfate ChEBI (2,4-dimethylphenyl)oxidanesulfonic acid IUPAC 2,4-dimethylphenol sulfate ChEBI Last Modified 06 May 2022