1-Bromo-3-(dimethoxymethyl)benzene
TL;DR: 1-Bromo-3-(dimethoxymethyl)benzene (CAS 67073-72-7) is a chemical compound with molecular formula C9H11BrO2 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-(dimethoxymethyl)benzene
Also Known As: 1-Bromo-3-(dimethoxymethyl)benzene, 3-Bromobenzaldehyde dimethyl acetal, 3-(dimethoxymethyl)bromobenzene, 1-Bromo-3-dimethoxymethyl-benzene, Benzene, 1-bromo-3-(dimethoxymethyl)-
| Molecular Formula | C9H11BrO2 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.99425 |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 67073-72-7 |
|---|---|
| SMILES | COC(C1=CC(=CC=C1)Br)OC |
| InChIKey | LEWBSVBRCPCEKV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-3-(dimethoxymethyl)benzene (CAS 67073-72-7), with molecular formula C9H11BrO2 and molecular weight 229.99 g/mol. IUPAC: 1-bromo-3-(dimethoxymethyl)benzene.
Chemical Property Profile of 1-Bromo-3-(dimethoxymethyl)benzene
Property Insights of 1-Bromo-3-(dimethoxymethyl)benzene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-3-(dimethoxymethyl)benzene. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Bromo-3-(dimethoxymethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3-(dimethoxymethyl)benzene has 0 hydrogen bond donor(s) and 2 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 1-Bromo-3-(dimethoxymethyl)benzene?
The CAS number of 1-Bromo-3-(dimethoxymethyl)benzene is 67073-72-7.
What is the molecular formula of 1-Bromo-3-(dimethoxymethyl)benzene?
The molecular formula of 1-Bromo-3-(dimethoxymethyl)benzene is C9H11BrO2.
What is the molecular weight of 1-Bromo-3-(dimethoxymethyl)benzene?
The molecular weight of 1-Bromo-3-(dimethoxymethyl)benzene is 229.99 g/mol.
Where can I buy 1-Bromo-3-(dimethoxymethyl)benzene?
You can request a quote for 1-Bromo-3-(dimethoxymethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-3-(dimethoxymethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3-(dimethoxymethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.