303146-26-1
Product Name:
5-ACETYL-2-(ETHYLSULFANYL)-6-METHYLNICOTINONITRILE
Formula:
C11H12N2OS
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 220.29 g/mol |
---|---|
XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 220.06703418 g/mol |
Monoisotopic Mass | 220.06703418 g/mol |
Topological Polar Surface Area | 79 Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 284 |
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 | 1 |
Compound Is Canonicalized | Yes |