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3-(Phenylsulfonyl)-Benzoic Acid
[CAS# 2548-44-9]

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Identification
Name 3-(Phenylsulfonyl)-Benzoic Acid
Synonyms Nsc 43055; 3-(Phenylsulfonyl)Benzoic Acid; Aids-124649
Molecular Structure CAS#: 2548-44-9, 3-(Phenylsulfonyl)-Benzoic Acid
Molecular Formula C13H10O4S
Molecular Weight 262.28
CAS Registry Number 2548-44-9
SMILES C1=CC=C(C=C1C(O)=O)[S](=O)(=O)C2=CC=CC=C2
InChI 1S/C13H10O4S/c14-13(15)10-5-4-8-12(9-10)18(16,17)11-6-2-1-3-7-11/h1-9H,(H,14,15)
InChIKey MAVYXMCSVGUDEZ-UHFFFAOYSA-N
Properties
Density 1.378g/cm3 (Cal.)
Boiling point 506.434°C at 760 mmHg (Cal.)
Flash point 260.082°C (Cal.)
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