12-Deacetoxyscalaradial
TL;DR: 12-Deacetoxyscalaradial (CAS 154554-90-2) is a chemical compound with molecular formula C25H38O2 and molecular weight 370.28717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4aS,4bR,6aS,10aS,10bR,12aS)-4b,7,7,10a,12a-pentamethyl-1,4,4a,5,6,6a,8,9,10,10b,11,12-dodecahydrochrysene-1,2-dicarbaldehyde
Also Known As: Scalarenedial, 12-Deacetoxyscalaradial, (-)-Scalarenedial, (-)-12-Deacetoxyscalaradial, D-Homoandrost-16-ene-17,17a-dicarboxaldehyde, 4,4,8-trimethyl-, (5alpha,17abeta)-
Technical Specifications
| Molecular Formula | C25H38O2 |
| Molecular Weight | 370.28717 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.28717 Da |
| Heavy Atoms | 27 |
| Complexity | 676.0 |
| SMILES | C[C@]12CCCC([C@@H]1CC[C@@]3([C@@H]2CC[C@]4([C@H]3CC=C([C@@H]4C=O)C=O)C)C)(C)C |
| InChIKey | QNKOIQITFODMFG-RNDOZLNUSA-N |
Chemical Property Profile of 12-Deacetoxyscalaradial
Property Insights of 12-Deacetoxyscalaradial
The XLogP value of 6.8 indicates that 12-Deacetoxyscalaradial is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 12-Deacetoxyscalaradial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-Deacetoxyscalaradial has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 12-Deacetoxyscalaradial?
The CAS number of 12-Deacetoxyscalaradial is 154554-90-2.
What is the molecular formula of 12-Deacetoxyscalaradial?
The molecular formula of 12-Deacetoxyscalaradial is C25H38O2.
What is the molecular weight of 12-Deacetoxyscalaradial?
The molecular weight of 12-Deacetoxyscalaradial is 370.28717 g/mol.
Where can I buy 12-Deacetoxyscalaradial?
You can request a quote for 12-Deacetoxyscalaradial directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 12-Deacetoxyscalaradial?
Yes, CoreyChem provides custom synthesis services for 12-Deacetoxyscalaradial and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.