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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

IUPAC name:
thiobenzoic acid

Inventory

EC number:
202-712-9
EC name:
Thiobenzoic acid
CAS number:
98-91-9
CAS number:
98-91-9
Synonyms
Names:
Benzenecarbothioic acid
Identifier:
IUPAC name
benzenecarbothioic S-acid
Identifier:
other: Molecular formula
C7H6OS
Identifier:
other: InChl
InChI=1/C7H6OS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
Identifier:
other: SMILES notation
SC(=O)c1ccccc1
Thiobenzoic acid

Molecular and structural information

Molecular formula:
C6H5COSH
Molecular weight:
ca. 138.19
SMILES notation:
C1=CC=C(C=C1)C(=O)S
InChl:
1/C7H6OS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
Structural formula:
Chemical structure

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