Padimate-O
TL;DR: Padimate-O (CAS 21245-02-3) is a chemical compound with molecular formula C17H27NO2 and molecular weight 277.2042 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethylhexyl 4-(dimethylamino)benzoate
Also Known As: Padimate O, 2-Ethylhexyl 4-(dimethylamino)benzoate, Padimate-O, Octyl dimethyl PABA, Escalol 507
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H27NO2 |
| Molecular Weight | 277.2042 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 277.2042 Da |
| Heavy Atoms | 20 |
| Complexity | 270.0 |
| Boiling Point | 362 |
| Density | 0.995 g/cu cm at 25 °C |
| Solubility | Insoluble |
| SMILES | CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C |
| InChIKey | WYWZRNAHINYAEF-UHFFFAOYSA-N |
Chemical Property Profile of Padimate-O
Property Insights of Padimate-O
The XLogP value of 5.0 indicates that Padimate-O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Padimate-O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Padimate-O has 0 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 Padimate-O?
The CAS number of Padimate-O is 21245-02-3.
What is the molecular formula of Padimate-O?
The molecular formula of Padimate-O is C17H27NO2.
What is the molecular weight of Padimate-O?
The molecular weight of Padimate-O is 277.2042 g/mol.
Where can I buy Padimate-O?
You can request a quote for Padimate-O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Padimate-O?
Yes, CoreyChem provides custom synthesis services for Padimate-O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.