Pentanoic acid, 2-acetyl-4-oxo-, methyl ester
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Pentanoic acid, 2-acetyl-4-oxo-, methyl ester
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CAS No:
85392-47-8
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Formula:
C8H12O4
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Chemical Name:
Pentanoic acid, 2-acetyl-4-oxo-, methyl ester
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Synonyms:
Pentanoic acid,2-acetyl-4-oxo-,methyl ester;Methyl 2-acetyl-4-oxopentanoate
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CAS No:
Pentanoic acid, 2-acetyl-4-oxo-, methyl ester Basic Attributes
172.17800
172.18
286-906-9
2918300090
Computed Properties
Molecular Weight:172.18
XLogP3:-0.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:172.07355886
Monoisotopic Mass:172.07355886
Topological Polar Surface Area:60.4
Heavy Atom Count:12
Complexity:207
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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