4-acetyl-4-prop-1-en-2-ylheptanedioic acid
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4-acetyl-4-prop-1-en-2-ylheptanedioic acid
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CAS No:
412036-11-4
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Formula:
C12H18O5
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Chemical Name:
4-acetyl-4-prop-1-en-2-ylheptanedioic acid
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Synonyms:
NSC71595;4-acetyl-4-isopropenyl-heptanedioic acid;NCIOpen2_003841;ZINC1697008;NSC-71595;4-Acetyl-4-isopropenylheptanedioic acid;412036-11-4
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CAS No:
Computed Properties
Molecular Weight:242.27
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:242.11542367
Monoisotopic Mass:242.11542367
Topological Polar Surface Area:91.7
Heavy Atom Count:17
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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