3-(4-acetamido-3-nitrophenyl)-3-methylbutanoic acid
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3-(4-acetamido-3-nitrophenyl)-3-methylbutanoic acid
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CAS No:
33214-73-2
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Formula:
C13H16N2O5
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Chemical Name:
3-(4-acetamido-3-nitrophenyl)-3-methylbutanoic acid
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Synonyms:
NSC245123;33214-73-2;3-{4-(acetylamino)-3-nitrophenyl}-3-methylbutanoic acid;DTXSID10311750;ZINC5369289;NSC-245123;DS-004559;AE-562/43460618;3-(4-acetamido-3-nitro-phenyl)-3-methyl-butanoic acid
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CAS No:
3-(4-acetamido-3-nitrophenyl)-3-methylbutanoic acid Basic Attributes
280.28 g/mol
280.10592162 g/mol
245123
DTXSID10311750
Computed Properties
Molecular Weight:280.28
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:280.10592162
Monoisotopic Mass:280.10592162
Topological Polar Surface Area:112
Heavy Atom Count:20
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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