1093625-96-7
Product Name:
(2S,3R,6RS)-2-(3-Oxobutyl)-3-Methyl-6-[(R)-2-propanal]cyclohexanone
Formula:
C14H22O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 238.32 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 238.15689456 g/mol |
| Monoisotopic Mass | 238.15689456 g/mol |
| Topological Polar Surface Area | 51.2 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 309 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |