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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

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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