3571-88-8
Product Name:
2,2'-[3-[(3-heptyl-4-methyl-3H-thiazol-2-ylidene)ethylidene]propenylene]bis[3-heptyl-4-methylthiazolium] diiodide
Formula:
C38H61I2N3S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 909.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 22 |
| Exact Mass | 909.21171 g/mol |
| Monoisotopic Mass | 909.21171 g/mol |
| Topological Polar Surface Area | 92.8 Ų |
| Heavy Atom Count | 46 |
| Formal Charge | 0 |
| Complexity | 862 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |