2-Bromo-3,4-dimethoxybenzaldehyde
TL;DR: 2-Bromo-3,4-dimethoxybenzaldehyde (CAS 55171-60-3) is a chemical compound with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-3,4-dimethoxybenzaldehyde
Also Known As: 2-Bromo-3,4-dimethoxybenzaldehyde, 2-Bromoveratraldehyde, Metcaraphen, 2-bromoveratraldhyde, o-bromoveratraldehyde
| Molecular Formula | C9H9BrO3 |
|---|---|
| Molecular Weight | 243.97 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.97351 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 55171-60-3 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C=O)Br)OC |
| InChIKey | BWFRHSRQIKGLLM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-3,4-dimethoxybenzaldehyde (CAS 55171-60-3), with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol. IUPAC: 2-bromo-3,4-dimethoxybenzaldehyde.
Chemical Property Profile of 2-Bromo-3,4-dimethoxybenzaldehyde
Property Insights of 2-Bromo-3,4-dimethoxybenzaldehyde
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-3,4-dimethoxybenzaldehyde. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Bromo-3,4-dimethoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-3,4-dimethoxybenzaldehyde 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 2-Bromo-3,4-dimethoxybenzaldehyde?
The CAS number of 2-Bromo-3,4-dimethoxybenzaldehyde is 55171-60-3.
What is the molecular formula of 2-Bromo-3,4-dimethoxybenzaldehyde?
The molecular formula of 2-Bromo-3,4-dimethoxybenzaldehyde is C9H9BrO3.
What is the molecular weight of 2-Bromo-3,4-dimethoxybenzaldehyde?
The molecular weight of 2-Bromo-3,4-dimethoxybenzaldehyde is 243.97 g/mol.
Where can I buy 2-Bromo-3,4-dimethoxybenzaldehyde?
You can request a quote for 2-Bromo-3,4-dimethoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-3,4-dimethoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-3,4-dimethoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.