4-(Phenylsulfonyl)benzoic acid
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4-(Phenylsulfonyl)benzoic acid
structure -
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CAS No:
5361-54-6
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Formula:
C13H10O4S
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Chemical Name:
4-(Phenylsulfonyl)benzoic acid
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Synonyms:
Benzoic acid,4-(phenylsulfonyl)-;Benzoic acid,p-(phenylsulfonyl)-;4-(Phenylsulfonyl)benzoic acid;p-(Phenylsulfonyl)benzoic acid;p-Carboxyphenyl phenyl sulfone;4-Carboxydiphenyl sulfone;NSC 3667;NSC 91053
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CAS No:
4-(Phenylsulfonyl)benzoic acid Basic Attributes
262.28
262.28
1533716-785-6
91053|3667
DTXSID5063815
2916399090
Characteristics
79.82000
2.53
1.4±0.1 g/cm3
266-268 °C
486.6±28.0 °C at 760 mmHg
248.1±24.0 °C
1.617
Safety Information
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302
4-(Phenylsulfonyl)benzoic acid Use and Manufacturing
Benzoic acid, 4-(phenylsulfonyl)-: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:262.28
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:262.02997997
Monoisotopic Mass:262.02997997
Topological Polar Surface Area:79.8
Heavy Atom Count:18
Complexity:382
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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