3-(2-methylphenyl)sulfanylpropanoic acid
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3-(2-methylphenyl)sulfanylpropanoic acid
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CAS No:
59280-48-7
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Formula:
C10H12O2S
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Chemical Name:
3-(2-methylphenyl)sulfanylpropanoic acid
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Synonyms:
3-[(2-methylphenyl)thio]propanoic acid; 3-o-tolylsulfanyl-propionic acid; 3-o-Tolylmercapto-propionsaeure; 3-(2-Methyl-phenylmercapto)-propionsaeure;
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CAS No:
3-(2-methylphenyl)sulfanylpropanoic acid Basic Attributes
196.26600
196.05580079 g/mol
108807
DTXSID00296325
2930909090
Computed Properties
Molecular Weight:196.27
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:196.05580079
Monoisotopic Mass:196.05580079
Topological Polar Surface Area:62.6
Heavy Atom Count:13
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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