3-(2-nitro-1-phenylethyl)pentane-2,4-dione
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3-(2-nitro-1-phenylethyl)pentane-2,4-dione
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CAS No:
72709-61-6
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Formula:
C13H15NO4
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Chemical Name:
3-(2-nitro-1-phenylethyl)pentane-2,4-dione
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Synonyms:
3-acetyl-5-nitro-4-phenylpentan-2-one; 3-Nitro-1,1-diacetyl-2-phenylpropane;
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CAS No:
3-(2-nitro-1-phenylethyl)pentane-2,4-dione Basic Attributes
249.26200
249.10010796 g/mol
160882
DTXSID80303743
Computed Properties
Molecular Weight:249.26
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:249.10010796
Monoisotopic Mass:249.10010796
Topological Polar Surface Area:80
Heavy Atom Count:18
Complexity:314
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-(2-nitro-1-phenylethyl)pentane-2,4-dione
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