2-(benzenesulfinylmethyl)benzoic acid
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2-(benzenesulfinylmethyl)benzoic acid
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CAS No:
25562-83-8
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Formula:
C14H12O3S
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Chemical Name:
2-(benzenesulfinylmethyl)benzoic acid
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Synonyms:
2-[(phenylsulfinyl)methyl]benzoic acid; 2-Phenylsulfinylmethyl-benzoesaeure; HMS557M15;
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CAS No:
2-(benzenesulfinylmethyl)benzoic acid Basic Attributes
260.30800
260.05071541
DTXSID20385003
2930909090
Characteristics
73.58000
3.55830
1.38g/cm3
185ºC
501ºC at 760mmHg
256.8ºC
1.683
7.38E-11mmHg at 25°C
Computed Properties
Molecular Weight:260.31
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:260.05071541
Monoisotopic Mass:260.05071541
Topological Polar Surface Area:73.6
Heavy Atom Count:18
Complexity:310
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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