1397243-57-0
Product Name:
3-(tert-butoxycarbonylamino)-2-cyanobenzoic acid
Formula:
C13H14N2O4
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COMPUTED DESCRIPTORS
Molecular Weight | 262.26 g/mol |
---|---|
XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 262.09535693 g/mol |
Monoisotopic Mass | 262.09535693 g/mol |
Topological Polar Surface Area | 99.4 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 405 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |