2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid
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![2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9d42f9651e604fd785f008bf2b02a2c3.png "2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid")
2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid
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CAS No:
27124-95-4
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Formula:
C16H22O4S
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Chemical Name:
2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid
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Synonyms:
MLS002919935;27124-95-4;NSC127380;CHEMBL2356941;DTXSID20298987;NSC-127380;SMR001797534
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CAS No:
2-[2-(3,4-dimethoxyphenyl)cyclohexyl]sulfanylacetic acid Basic Attributes
310.4 g/mol
310.12388035 g/mol
127380
DTXSID20298987
Computed Properties
Molecular Weight:310.4
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:310.12388035
Monoisotopic Mass:310.12388035
Topological Polar Surface Area:81.1
Heavy Atom Count:21
Complexity:336
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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