Flexirubin
TL;DR: Flexirubin (CAS 1241047-66-4) is a chemical compound with molecular formula C43H54O4 and molecular weight 634.4022 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-dodecyl-3-hydroxy-5-methylphenyl) (2E,4E,6E,8E,10E,12E,14E,16E)-17-(4-hydroxy-3-methylphenyl)heptadeca-2,4,6,8,10,12,14,16-octaenoate
Also Known As: Flexirubin, Flexirubins, EINECS 259-124-0, J3.219.421D, (2-dodecyl-3-hydroxy-5-methylphenyl) (2E,4E,6E,8E,10E,12E,14E,16E)-17-(4-hydroxy-3-methylphenyl)heptadeca-2,4,6,8,10,12,14,16-octaenoate
Technical Specifications
| Molecular Formula | C43H54O4 |
| Molecular Weight | 634.4022 g/mol |
| XLogP | 14.5 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 22 |
| Exact Mass | 634.4022 Da |
| Heavy Atoms | 47 |
| Complexity | 1060.0 |
| SMILES | CCCCCCCCCCCCC1=C(C=C(C=C1OC(=O)/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C2=CC(=C(C=C2)O)C)C)O |
| InChIKey | GFNJWVBJKYYUIN-CMUOTRNOSA-N |
Chemical Property Profile of Flexirubin
Property Insights of Flexirubin
The XLogP value of 14.5 indicates that Flexirubin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Flexirubin. Following Lipinski's Rule of Five, Flexirubin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Flexirubin?
The CAS number of Flexirubin is 1241047-66-4.
What is the molecular formula of Flexirubin?
The molecular formula of Flexirubin is C43H54O4.
What is the molecular weight of Flexirubin?
The molecular weight of Flexirubin is 634.4022 g/mol.
Where can I buy Flexirubin?
You can request a quote for Flexirubin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Flexirubin?
Yes, CoreyChem provides custom synthesis services for Flexirubin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.