Vinigrol
TL;DR: Vinigrol (CAS 111025-83-3) is a chemical compound with molecular formula C20H34O3 and molecular weight 322.2508 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2R,5R,6S,9S,10R,13S,14S)-12-(hydroxymethyl)-2,9-dimethyl-6-propan-2-yltricyclo[8.4.0.05,14]tetradec-11-ene-1,13-diol
Also Known As: Vinigrol, PTS18 Trisodium 8-octadecyloxypyrene-1,3,6-trisulfonate, (1S,2R,5R,6S,9S,10R,13S,14S)-12-(Hydroxymethyl)-2,9-dimethyl-6-propan-2-yltricyclo[8.4.0.05,14]tetradec-11-ene-1,13-diol, (1S,2R,5S,6S,9S,10R,13S,14S)-12-(hydroxymethyl)-2,9-dimethyl-6-propan-2-yltricyclo(8.4.0.05,14)tetradec-11-ene-1,13-diol
Technical Specifications
| Molecular Formula | C20H34O3 |
| Molecular Weight | 322.2508 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.2508 Da |
| Heavy Atoms | 23 |
| Complexity | 472.0 |
| SMILES | C[C@H]1CC[C@H]([C@H]2CC[C@H]([C@@]3([C@H]1C=C([C@H]([C@H]23)O)CO)O)C)C(C)C |
| InChIKey | UADXIAKXDDMQEN-PEOWTYOISA-N |
Chemical Property Profile of Vinigrol
Property Insights of Vinigrol
The XLogP value of 3.7 indicates that Vinigrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Vinigrol. Following Lipinski's Rule of Five, Vinigrol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Vinigrol?
The CAS number of Vinigrol is 111025-83-3.
What is the molecular formula of Vinigrol?
The molecular formula of Vinigrol is C20H34O3.
What is the molecular weight of Vinigrol?
The molecular weight of Vinigrol is 322.2508 g/mol.
Where can I buy Vinigrol?
You can request a quote for Vinigrol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Vinigrol?
Yes, CoreyChem provides custom synthesis services for Vinigrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.