1142-70-7
Product Name:
5-(2-bromoallyl)-5-(1-methylpropyl)-1H,3H,5H-pyrimidine-2,4,6-trione
Formula:
C11H15BrN2O3
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CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1944 1944 1969 1980 1975 1995 |
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COMPUTED DESCRIPTORS
Molecular Weight | 303.15 g/mol |
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XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 302.02660 g/mol |
Monoisotopic Mass | 302.02660 g/mol |
Topological Polar Surface Area | 75.3 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 372 |
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 |