4-Bromoanisole
TL;DR: 4-Bromoanisole (CAS 104-92-7) is a chemical compound with molecular formula C7H7BrO and molecular weight 185.96803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-4-methoxybenzene
Also Known As: 4-BROMOANISOLE, 1-Bromo-4-methoxybenzene, p-Bromoanisole, Anisyl bromide, 4-Methoxybromobenzene
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H7BrO |
| Molecular Weight | 185.96803 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.96803 Da |
| Heavy Atoms | 9 |
| Complexity | 77.0 |
| SMILES | COC1=CC=C(C=C1)Br |
| InChIKey | QJPJQTDYNZXKQF-UHFFFAOYSA-N |
Product Description
Applications: 4-Bromoanisole is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Bromoanisole (CAS 104-92-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4-Bromoanisole (CAS 104-92-7) is a heterocyclic building block with the molecular formula C7H7BrO and a molecular weight of 185.97 g/mol. It is also known as 4-BROMOANISOLE and 1-Bromo-4-methoxybenzene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Bromoanisole
Property Insights of 4-Bromoanisole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromoanisole. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Bromoanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromoanisole has 0 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-Bromoanisole?
The CAS number of 4-Bromoanisole is 104-92-7.
What is the molecular formula of 4-Bromoanisole?
The molecular formula of 4-Bromoanisole is C7H7BrO.
What is the molecular weight of 4-Bromoanisole?
The molecular weight of 4-Bromoanisole is 185.96803 g/mol.
What are the applications of 4-Bromoanisole?
4-Bromoanisole is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Bromoanisole (CAS 104-92-7) with...
Where can I buy 4-Bromoanisole?
You can request a quote for 4-Bromoanisole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromoanisole?
Yes, CoreyChem provides custom synthesis services for 4-Bromoanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
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