2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid
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![2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8890218bbb834ef49e6ae5109c7a547d.png "2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid")
2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid
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CAS No:
5330-94-9
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Formula:
C14H18O5S
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Chemical Name:
2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid
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Synonyms:
5330-94-9;2-{[1-(4-methoxyphenyl)propan-2-yl]sulfanyl}butanedioic acid;NSC2541;DTXSID70277489;NSC-2541;[[2-(4-METHOXYPHENYL)-1-METHYLETHYL]THIO]SUCCINIC ACID
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CAS No:
2-[1-(4-methoxyphenyl)propan-2-ylsulfanyl]butanedioic acid Basic Attributes
298.36 g/mol
298.08749484 g/mol
2541
DTXSID70277489
Computed Properties
Molecular Weight:298.36
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:298.08749484
Monoisotopic Mass:298.08749484
Topological Polar Surface Area:109
Heavy Atom Count:20
Complexity:326
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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