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(Phenylsulphonyl)Acetic Acid
[CAS# 3959-23-7]

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Identification
Name (Phenylsulphonyl)Acetic Acid
Synonyms 2-Phenylsulfonylethanoic Acid; Nsc32353; Sdccgmls-0065649.P001
Molecular Structure CAS#: 3959-23-7, (Phenylsulphonyl)Acetic Acid
Molecular Formula C8H8O4S
Molecular Weight 200.21
CAS Registry Number 3959-23-7
SMILES C1=C([S](CC(O)=O)(=O)=O)C=CC=C1
InChI 1S/C8H8O4S/c9-8(10)6-13(11,12)7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
InChIKey YTEFAALYDTWTLB-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Melting point 109-114°C (Expl.)
Boiling point 452.2±37.0°C at 760 mmHg (Cal.)
Flash point 227.3±26.5°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 (Phenylsulphonyl)Acetic Acid
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