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16397-70-9

16397-70-9 structural image
Product Name: 4-NITRO BENZOIC ACID 2-ETHYL-HEXYL ESTER
Formula: C15H21NO4
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COMPUTED DESCRIPTORS

Molecular Weight 279.33 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 279.14705815 g/mol
Monoisotopic Mass 279.14705815 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 306
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes