2-butan-2-yl-2-ethylpropanedioic acid
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2-butan-2-yl-2-ethylpropanedioic acid
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CAS No:
4372-17-2
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Formula:
C9H16O4
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Chemical Name:
2-butan-2-yl-2-ethylpropanedioic acid
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Synonyms:
2-Sec-butyl-2-ethylmalonic acid;4372-17-2;NSC27691;NSC49164;NSC 27691;2-butan-2-yl-2-ethylpropanedioic acid;SCHEMBL3640223;ethyl 2-(2-butyl)malonic acid;NSC-27691;NSC-49164;2-ethyl-2-sec-butyl-propanedioic acid
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CAS No:
Computed Properties
Molecular Weight:188.22
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:188.10485899
Monoisotopic Mass:188.10485899
Topological Polar Surface Area:74.6
Heavy Atom Count:13
Complexity:196
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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