7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carboxylic acid
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7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carboxylic acid
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CAS No:
18625-95-1
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Formula:
C10H10O5
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Chemical Name:
7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carboxylic acid
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Synonyms:
NSC229525;18625-95-1;6-methyl-cyclohex-4-ene-1,2,3-tricarboxylic acid-1,2-anhydride;7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carboxylic acid;NSC-229525;6-Methyl-4-cyclohexene-1,2,3-tricarboxylic 1,2-anhydride;7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisobenzofuran-4-carboxylic acid;7-Methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2-benzofuran-4-carboxylic acid
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CAS No:
7-methyl-1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carboxylic acid Basic Attributes
210.18 g/mol
210.05282342 g/mol
229525
Computed Properties
Molecular Weight:210.18
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:210.05282342
Monoisotopic Mass:210.05282342
Topological Polar Surface Area:80.7
Heavy Atom Count:15
Complexity:370
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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