3-methoxycarbonyl-4-(5-methylfuran-2-yl)but-3-enoic acid
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3-methoxycarbonyl-4-(5-methylfuran-2-yl)but-3-enoic acid
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CAS No:
37978-59-9
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Formula:
C11H12O5
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Chemical Name:
3-methoxycarbonyl-4-(5-methylfuran-2-yl)but-3-enoic acid
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Synonyms:
Butanedioic acid,2-[(5-methyl-2-furanyl)methylene]-,1-methyl ester,(2E); 3-methoxycarbonyl-4-(5-methyl-2-furanyl)-3-butenoic acid; Butanedioicacid,[(5-methyl-2-furanyl)methylene]-,1-methyl ester,(2E)-(9CI); Butanedioicacid,[(5-methyl-2-furanyl)methylene]-,1-methyl ester,(E); E-3-methoxycarbonyl-4-(5-methylfur-2-yl)-but-3-enoic acid;
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CAS No:
3-methoxycarbonyl-4-(5-methylfuran-2-yl)but-3-enoic acid Basic Attributes
224.21000
224.06847348
DTXSID80697710
2932190090
Computed Properties
Molecular Weight:224.21
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:224.06847348
Monoisotopic Mass:224.06847348
Topological Polar Surface Area:76.7
Heavy Atom Count:16
Complexity:308
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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