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Reference substances

Currently viewing:
IUPAC name:
4-ethylbenzene sulphonic acid

Inventory

EC number:
202-693-7
EC name:
p-ethylbenzenesulphonic acid
CAS number:
98-69-1
CAS number:
98-69-1
Synonyms
Names:
Identifier:
IUPAC name
4-ethylbenzenesulfonic acid
Identifier:
IUPAC name
p-ethylbenzenesulphonic acid
Identifier:
other: Molecular formula
C8H10O3S
Identifier:
other: SMILES notation
CCc1ccc(cc1)S(=O)(=O)O
Identifier:
other: InChl
InChI=1/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)
Identifier:
other: SMILES notation
CCc1ccc(cc1)S(=O)(=O)O
Identifier:
other: InChl
InChI=1/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)

Molecular and structural information

Molecular formula:
C8H10O3S
Molecular weight:
186.23
SMILES notation:
CCC1=CC=C(C=C1)S(=O)(=O)O
InChl:
InChI=1S/C8H10O3S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)
Structural formula:
Chemical structure

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