115524-22-6
Product Name:
(2R,3R)-4-BROMO-1-CARBOXY-2,3-DIHYDROXYCYCLOHEXA-4,6-DIENE, 95
Formula:
C7H7BrO4
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 235.03 g/mol |
---|---|
XLogP3 | 0.2 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 1 |
Exact Mass | 233.95277 g/mol |
Monoisotopic Mass | 233.95277 g/mol |
Topological Polar Surface Area | 77.8 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 269 |
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 |