3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde
TL;DR: 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde (CAS 119647-24-4) is a chemical compound with molecular formula C11H13BrO2 and molecular weight 256.0099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-5-tert-butyl-2-hydroxybenzaldehyde
Also Known As: 3-bromo-5-tert-butyl-2-hydroxybenzaldehyde, 3-Bromo-5-(tert-butyl)-2-hydroxybenzaldehyde, 3-bromo-5-tert-butylsalicylaldehyde, 3-Bromo-5-tert-butyl-2-hydroxy-benzaldehyde, 3-Bromo-5-tert-butyl-salicylaldehyde
Technical Specifications
| Molecular Formula | C11H13BrO2 |
| Molecular Weight | 256.0099 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0099 Da |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)Br)O)C=O |
| InChIKey | TUTMRJRVZVXKAM-UHFFFAOYSA-N |
Chemical Property Profile of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde
Property Insights of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde
The XLogP value of 3.9 indicates that 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde?
The CAS number of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde is 119647-24-4.
What is the molecular formula of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde?
The molecular formula of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde is C11H13BrO2.
What is the molecular weight of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde?
The molecular weight of 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde is 256.0099 g/mol.
Where can I buy 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde?
You can request a quote for 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 3-Bromo-5-tert-butyl-2-hydroxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.