1-(2-Ethylhexyl) 2-butenedioate
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1-(2-Ethylhexyl) 2-butenedioate
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CAS No:
45173-95-3
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Formula:
C12H20O4
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Chemical Name:
1-(2-Ethylhexyl) 2-butenedioate
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Synonyms:
2-Butenedioic acid,1-(2-ethylhexyl) ester;2-Butenedioic acid,mono(2-ethylhexyl) ester;1-(2-Ethylhexyl) 2-butenedioate
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CAS No:
Computed Properties
Molecular Weight:228.28
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:228.13615911
Monoisotopic Mass:228.13615911
Topological Polar Surface Area:63.6
Heavy Atom Count:16
Complexity:245
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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