672309-91-0
Product Name:
7-BROMO-2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPINE-2-CARBOXYLIC ACID METHYL ESTER
Formula:
C11H13BrN2O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 285.14 g/mol |
---|---|
XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 284.01604 g/mol |
Monoisotopic Mass | 284.01604 g/mol |
Topological Polar Surface Area | 50.4 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 262 |
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 |