853681-16-0
Product Name:
(3E)-2-(4-BOC-PIPERAZINYL)-4-PHENYL-3-BUTENOIC ACID
Formula:
C19H26N2O4
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SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
COMPUTED DESCRIPTORS
| Molecular Weight | 346.4 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 346.18925731 g/mol |
| Monoisotopic Mass | 346.18925731 g/mol |
| Topological Polar Surface Area | 70.1 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 484 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |