138623-83-3
![138623-83-3 structural image](https://img.chemicalbook.in/CAS/GIF/138623-83-3.gif)
Product Name:
3-(3-SULFOPROPYL)-2-([3-[(3-SULFOPROPYL)-2-BENZOTHIAZOLINYLIDENE) METHYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]METHYL)BENZOTHIAZOLIUM INNER SALT SODIUM SALT
Formula:
C30H33N2NaO6S4
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COMPUTED DESCRIPTORS
Molecular Weight | 668.9 g/mol |
---|---|
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 8 |
Exact Mass | 668.11191575 g/mol |
Monoisotopic Mass | 668.11191575 g/mol |
Topological Polar Surface Area | 192 Ų |
Heavy Atom Count | 43 |
Formal Charge | 0 |
Complexity | 1160 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 2 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 2 |
Compound Is Canonicalized | Yes |