Heptanoic acid, 3-oxo-, ethyl ester
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Heptanoic acid, 3-oxo-, ethyl ester
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CAS No:
7737-62-4
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Formula:
C9H16O3
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Chemical Name:
Heptanoic acid, 3-oxo-, ethyl ester
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Synonyms:
Heptanoic acid,3-oxo-,ethyl ester;Ethyl β-oxoheptanoate;Ethyl 3-oxoheptanoate;3-Oxoheptanoic acid ethyl ester;Ethyl 3-ketoheptanoate;Ethyl valeroylacetate
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CAS No:
Safety Information
23-24/25
Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P280, P370+P378, P403+P235, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:172.22
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:172.109944368
Monoisotopic Mass:172.109944368
Topological Polar Surface Area:43.4
Heavy Atom Count:12
Complexity:152
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Heptanoic acid, 3-oxo-, ethyl ester
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