Phenyl 3,5-diisopropylsalicylate
TL;DR: Phenyl 3,5-diisopropylsalicylate (CAS 16881-60-0) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.1569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl 2-hydroxy-3,5-di(propan-2-yl)benzoate
Also Known As: Phenyl 3,5-diisopropylsalicylate, phenyl 2-hydroxy-3,5-di(propan-2-yl)benzoate, phenyl 2-hydroxy-3,5-diisopropylbenzoate, 3,5-Diisopropylsalicylic acid phenyl ester, phenyl 2-hydroxy-3,5-bis(propan-2-yl)benzoate
Technical Specifications
| Molecular Formula | C19H22O3 |
| Molecular Weight | 298.1569 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.1569 Da |
| Heavy Atoms | 22 |
| Complexity | 358.0 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(=O)OC2=CC=CC=C2)O)C(C)C |
| InChIKey | YYEAGXUACASJES-UHFFFAOYSA-N |
Chemical Property Profile of Phenyl 3,5-diisopropylsalicylate
Property Insights of Phenyl 3,5-diisopropylsalicylate
The XLogP value of 5.8 indicates that Phenyl 3,5-diisopropylsalicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Phenyl 3,5-diisopropylsalicylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 3,5-diisopropylsalicylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phenyl 3,5-diisopropylsalicylate?
The CAS number of Phenyl 3,5-diisopropylsalicylate is 16881-60-0.
What is the molecular formula of Phenyl 3,5-diisopropylsalicylate?
The molecular formula of Phenyl 3,5-diisopropylsalicylate is C19H22O3.
What is the molecular weight of Phenyl 3,5-diisopropylsalicylate?
The molecular weight of Phenyl 3,5-diisopropylsalicylate is 298.1569 g/mol.
Where can I buy Phenyl 3,5-diisopropylsalicylate?
You can request a quote for Phenyl 3,5-diisopropylsalicylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenyl 3,5-diisopropylsalicylate?
Yes, CoreyChem provides custom synthesis services for Phenyl 3,5-diisopropylsalicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.