3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
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![3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6c5ebbbf219f4d369364b8176b92ead8.png "3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid")
3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
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CAS No:
6917-45-9
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Formula:
C14H22O5S
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Chemical Name:
3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
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Synonyms:
6917-45-9;NSC202749;DTXSID60308231;NSC-202749;3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
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CAS No:
3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid Basic Attributes
302.39 g/mol
302.11879497 g/mol
202749
DTXSID60308231
Computed Properties
Molecular Weight:302.39
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:302.11879497
Monoisotopic Mass:302.11879497
Topological Polar Surface Area:98.1
Heavy Atom Count:20
Complexity:360
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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