methylsulfinylmethyl 2-acetyloxybenzoate
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methylsulfinylmethyl 2-acetyloxybenzoate
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CAS No:
76432-33-2
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Formula:
C11H12O5S
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Chemical Name:
methylsulfinylmethyl 2-acetyloxybenzoate
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Synonyms:
methylsulfinylmethyl 2-acetoxybenzoate;MSMAB;76432-33-2;MSMAB;Benzoic acid, 2-(acetyloxy)-, (methylsulfinyl)methyl ester;Methylsulfinylmethyl 2-acetoxybenzoate;CHEMBL350274;2-Acetoxy-benzoic acid methanesulfinylmethyl ester;2-Acetoxybenzoic acid (methylsulfinyl)methyl ester
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CAS No:
Computed Properties
Molecular Weight:256.28
XLogP3:0.1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:256.04054465
Monoisotopic Mass:256.04054465
Topological Polar Surface Area:88.9
Heavy Atom Count:17
Complexity:315
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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