3-methylpent-1-yn-3-yl 2-phenylacetate
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3-methylpent-1-yn-3-yl 2-phenylacetate
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CAS No:
100883-28-1
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Formula:
C14H16O2
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Chemical Name:
3-methylpent-1-yn-3-yl 2-phenylacetate
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Synonyms:
100883-28-1;BRN 3261283;Phenylacetic acid 1-ethyl-1-methyl-2-propynyl ester;ACETIC ACID, PHENYL-, 1-ETHYL-1-METHYL-2-PROPYNYL ESTER;4-09-00-01621 (Beilstein Handbook Reference);DTXSID80905822;3-methylpent-1-yn-3-yl phenylacetate
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CAS No:
Computed Properties
Molecular Weight:216.27
XLogP3:2.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:216.115029749
Monoisotopic Mass:216.115029749
Topological Polar Surface Area:26.3
Heavy Atom Count:16
Complexity:280
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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