33522-69-9
Product Name:
4,6,6-trimethylbicyclo[3.1.1.]hept-3-en-2-yl acetate
Formula:
C12H18O2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1290 1282 1282 |
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COMPUTED DESCRIPTORS
Molecular Weight | 194.27 g/mol |
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XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 2 |
Exact Mass | 194.130679813 g/mol |
Monoisotopic Mass | 194.130679813 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 301 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 3 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |