1139697-95-2
Product Name:
decyl 2-[2-[(4-chlorophenoxy)methyl]-3-methylbenzimidazol-3-ium-1-yl]acetate chloride
Formula:
C27H36Cl2N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 507.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 15 |
| Exact Mass | 506.2102984 g/mol |
| Monoisotopic Mass | 506.2102984 g/mol |
| Topological Polar Surface Area | 44.3 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 556 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |