898777-06-5
Product Name:
ETHYL 5-(3-BROMO-5-METHYLPHENYL)-5-OXOVALERATE
Formula:
C14H17BrO3
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COMPUTED DESCRIPTORS
Molecular Weight | 313.19 g/mol |
---|---|
XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 7 |
Exact Mass | 312.03611 g/mol |
Monoisotopic Mass | 312.03611 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 291 |
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 |