175202-49-0
Product Name:
1-ACETYL-6,6-DIMETHYL-3-(METHYLTHIO)-4,5,6,7-TETRAHYDROBENZO[C]THIOPHEN-4-ONE
Formula:
C13H16O2S2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 268.4 g/mol |
---|---|
XLogP3 | 3.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 268.05917210 g/mol |
Monoisotopic Mass | 268.05917210 g/mol |
Topological Polar Surface Area | 87.7 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 351 |
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 |