91306-60-4
Product Name:
METHYL 5-(2-METHOXY-2-OXOETHYL)-1-(4-NITROPHENYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLATE
Formula:
C13H12N4O6
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COMPUTED DESCRIPTORS
Molecular Weight | 320.26 g/mol |
---|---|
XLogP3 | 1.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 6 |
Exact Mass | 320.07568412 g/mol |
Monoisotopic Mass | 320.07568412 g/mol |
Topological Polar Surface Area | 129 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 460 |
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 |