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4-Toluenesulfonylacetic Acid
[CAS# 3937-96-0]

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Identification
Name 4-Toluenesulfonylacetic Acid
Synonyms 2-(4-Methylphenyl)Sulfonylethanoic Acid; (4-Tolylsulphonyl)Acetic Acid
Molecular Structure CAS#: 3937-96-0, 4-Toluenesulfonylacetic Acid
Molecular Formula C9H10O4S
Molecular Weight 214.24
CAS Registry Number 3937-96-0
EINECS 223-518-0
SMILES C1=CC(=CC=C1[S](CC(O)=O)(=O)=O)C
InChI 1S/C9H10O4S/c1-7-2-4-8(5-3-7)14(12,13)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChIKey AQDHXMBUTDLAMD-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Melting point 118°C (Expl.)
Boiling point 450.4±45.0°C at 760 mmHg (Cal.)
Flash point 226.2±28.7°C (Cal.)
Safety Data
Safety Code S26;S37  Details
Risk Code R36/37/38  Details
Hazard Symbol symbol  X  Details
Safety Description WARNING: Irritates lungs, eyes, skin
IRRITANT
SDS Available
Market Analysis Reports
List of Reports Available for 4-Toluenesulfonylacetic Acid
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