1-(3-Bromopropyl)-3-methoxybenzene
TL;DR: 1-(3-Bromopropyl)-3-methoxybenzene (CAS 6943-97-1) is a chemical compound with molecular formula C10H13BrO and molecular weight 228.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromopropyl)-3-methoxybenzene
Also Known As: 1-(3-bromopropyl)-3-methoxybenzene, Anisole, m-(3-bromopropyl)-, Benzene, 1-(3-bromopropyl)-3-methoxy-, Anisole, m-(3-bromopropyl)-,, 3-(3-methoxyphenyl)propylbromide
| Molecular Formula | C10H13BrO |
|---|---|
| Molecular Weight | 228.01 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.01498 |
| Heavy Atoms | 12 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 6943-97-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CCCBr |
| InChIKey | LISAIUHOJQKVHK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Bromopropyl)-3-methoxybenzene (CAS 6943-97-1), with molecular formula C10H13BrO and molecular weight 228.01 g/mol. IUPAC: 1-(3-bromopropyl)-3-methoxybenzene.
Chemical Property Profile of 1-(3-Bromopropyl)-3-methoxybenzene
Property Insights of 1-(3-Bromopropyl)-3-methoxybenzene
The XLogP value of 3.7 indicates that 1-(3-Bromopropyl)-3-methoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(3-Bromopropyl)-3-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromopropyl)-3-methoxybenzene 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
Frequently Asked Questions
What is the CAS number of 1-(3-Bromopropyl)-3-methoxybenzene?
The CAS number of 1-(3-Bromopropyl)-3-methoxybenzene is 6943-97-1.
What is the molecular formula of 1-(3-Bromopropyl)-3-methoxybenzene?
The molecular formula of 1-(3-Bromopropyl)-3-methoxybenzene is C10H13BrO.
What is the molecular weight of 1-(3-Bromopropyl)-3-methoxybenzene?
The molecular weight of 1-(3-Bromopropyl)-3-methoxybenzene is 228.01 g/mol.
Where can I buy 1-(3-Bromopropyl)-3-methoxybenzene?
You can request a quote for 1-(3-Bromopropyl)-3-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bromopropyl)-3-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bromopropyl)-3-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.