Betulinaldehyde
TL;DR: Betulinaldehyde (CAS 13159-28-9) is a chemical compound with molecular formula C30H48O2 and molecular weight 440.36542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde
Also Known As: Betulinicaldehyde, BETULINALDEHYDE, Betulinic aldehyde, Betulinal, Betulin aldehyde
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C30H48O2 |
| Molecular Weight | 440.36542 g/mol |
| XLogP | 8.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 440.36542 Da |
| Heavy Atoms | 32 |
| Complexity | 814.0 |
| SMILES | CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C=O |
| InChIKey | FELCJAPFJOPHSD-ROUWMTJPSA-N |
Chemical Property Profile of Betulinaldehyde
Property Insights of Betulinaldehyde
The XLogP value of 8.1 indicates that Betulinaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Betulinaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Betulinaldehyde has 1 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 Betulinaldehyde?
The CAS number of Betulinaldehyde is 13159-28-9.
What is the molecular formula of Betulinaldehyde?
The molecular formula of Betulinaldehyde is C30H48O2.
What is the molecular weight of Betulinaldehyde?
The molecular weight of Betulinaldehyde is 440.36542 g/mol.
Where can I buy Betulinaldehyde?
You can request a quote for Betulinaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Betulinaldehyde?
Yes, CoreyChem provides custom synthesis services for Betulinaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.