azepan-2-ylmethyl 4-nitrobenzoate
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azepan-2-ylmethyl 4-nitrobenzoate
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CAS No:
5449-24-1
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Formula:
C14H18N2O4
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Chemical Name:
azepan-2-ylmethyl 4-nitrobenzoate
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Synonyms:
5449-24-1;azepan-2-ylmethyl 4-nitrobenzoate;NSC16290;DTXSID00280300;NSC-16290
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CAS No:
azepan-2-ylmethyl 4-nitrobenzoate Basic Attributes
278.30 g/mol
278.12665706 g/mol
16290
DTXSID00280300
Computed Properties
Molecular Weight:278.30
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:278.12665706
Monoisotopic Mass:278.12665706
Topological Polar Surface Area:84.2
Heavy Atom Count:20
Complexity:335
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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