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Product Name:
DIMETHYL 1-(4-FLUOROBENZYL)-5-METHYL-1H-PYRROLE-2,4-DICARBOXYLATE
Formula:
C16H16FNO4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 10.6 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 305.30 g/mol |
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XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 6 |
Exact Mass | 305.10633615 g/mol |
Monoisotopic Mass | 305.10633615 g/mol |
Topological Polar Surface Area | 57.5 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 409 |
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 |