4-Bromo-2,3,5-trimethylphenol
TL;DR: 4-Bromo-2,3,5-trimethylphenol (CAS 156483-07-7) is a chemical compound with molecular formula C9H11BrO and molecular weight 213.99933 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-2,3,5-trimethylphenol
Also Known As: 4-bromo-2,3,5-trimethylphenol, Phenol, 4-bromo-2,3,5-trimethyl-, 2,3,5-Trimethyl-4-bromophenol, Phenol,4-bromo-2,3,5-trimethyl, 4-bromanyl-2,3,5-trimethyl-phenol
Technical Specifications
| Molecular Formula | C9H11BrO |
| Molecular Weight | 213.99933 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.99933 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| SMILES | CC1=CC(=C(C(=C1Br)C)C)O |
| InChIKey | KHQCLZZWQARYJF-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromo-2,3,5-trimethylphenol
Property Insights of 4-Bromo-2,3,5-trimethylphenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2,3,5-trimethylphenol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Bromo-2,3,5-trimethylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2,3,5-trimethylphenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Bromo-2,3,5-trimethylphenol?
The CAS number of 4-Bromo-2,3,5-trimethylphenol is 156483-07-7.
What is the molecular formula of 4-Bromo-2,3,5-trimethylphenol?
The molecular formula of 4-Bromo-2,3,5-trimethylphenol is C9H11BrO.
What is the molecular weight of 4-Bromo-2,3,5-trimethylphenol?
The molecular weight of 4-Bromo-2,3,5-trimethylphenol is 213.99933 g/mol.
Where can I buy 4-Bromo-2,3,5-trimethylphenol?
You can request a quote for 4-Bromo-2,3,5-trimethylphenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromo-2,3,5-trimethylphenol?
Yes, CoreyChem provides custom synthesis services for 4-Bromo-2,3,5-trimethylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.