94856-91-4
Product Name:
1-(4-chlorobenzoyl)piperazine-2,3-dicarboxylic acid
Formula:
C13H13ClN2O5
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COMPUTED DESCRIPTORS
Molecular Weight | 312.70 g/mol |
---|---|
XLogP3 | -1.7 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 312.0512992 g/mol |
Monoisotopic Mass | 312.0512992 g/mol |
Topological Polar Surface Area | 107 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 436 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |