3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde
TL;DR: 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde (CAS 428476-80-6) is a chemical compound with molecular formula C12H15BrO3 and molecular weight 286.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-ethoxy-4-propan-2-yloxybenzaldehyde
Also Known As: 3-BROMO-5-ETHOXY-4-ISOPROPOXYBENZALDEHYDE, 3-bromo-5-ethoxy-4-(propan-2-yloxy)benzaldehyde, 3-bromo-5-ethoxy-4-propan-2-yloxybenzaldehyde, 3-bromo-5-ethoxy-4-(methylethoxy)benzaldehyde, 3-bromo-5-ethoxy-4-isopropoxy-benzaldehyde
| Molecular Formula | C12H15BrO3 |
|---|---|
| Molecular Weight | 286.02 g/mol |
| LogP | 3.4475 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.02045 |
| Heavy Atoms | 16 |
| Complexity | 374.7718 |
Chemical Identifiers
| CAS Number | 428476-80-6 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=O)Br)OC(C)C |
Product Overview
3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde (CAS 428476-80-6), with molecular formula C12H15BrO3 and molecular weight 286.02 g/mol. IUPAC: 3-bromo-5-ethoxy-4-propan-2-yloxybenzaldehyde.
Chemical Property Profile of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde
Property Insights of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde
The XLogP value of 3.4475 indicates that 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde 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
Frequently Asked Questions
What is the CAS number of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde?
The CAS number of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde is 428476-80-6.
What is the molecular formula of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde?
The molecular formula of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde is C12H15BrO3.
What is the molecular weight of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde?
The molecular weight of 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde is 286.02 g/mol.
Where can I buy 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde?
You can request a quote for 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-5-ethoxy-4-isopropoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.