1-Bromo-2-ethylbenzene
TL;DR: 1-Bromo-2-ethylbenzene (CAS 1973-22-4) is a chemical compound with molecular formula C8H9Br and molecular weight 183.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-ethylbenzene
Also Known As: 1-BROMO-2-ETHYLBENZENE, o-Bromoethylbenzene, 2-Bromoethylbenzene, Benzene, 1-bromo-2-ethyl-, 2-Ethylbromobenzene
| Molecular Formula | C8H9Br |
|---|---|
| Molecular Weight | 183.99 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.98875 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 1973-22-4 |
|---|---|
| SMILES | CCC1=CC=CC=C1Br |
| InChIKey | HVRUGFJYCAFAAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2-ethylbenzene (CAS 1973-22-4), with molecular formula C8H9Br and molecular weight 183.99 g/mol. IUPAC: 1-bromo-2-ethylbenzene.
Chemical Property Profile of 1-Bromo-2-ethylbenzene
Property Insights of 1-Bromo-2-ethylbenzene
The XLogP value of 3.5 indicates that 1-Bromo-2-ethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Bromo-2-ethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-ethylbenzene has 0 hydrogen bond donor(s) and 0 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-2-ethylbenzene?
The CAS number of 1-Bromo-2-ethylbenzene is 1973-22-4.
What is the molecular formula of 1-Bromo-2-ethylbenzene?
The molecular formula of 1-Bromo-2-ethylbenzene is C8H9Br.
What is the molecular weight of 1-Bromo-2-ethylbenzene?
The molecular weight of 1-Bromo-2-ethylbenzene is 183.99 g/mol.
Where can I buy 1-Bromo-2-ethylbenzene?
You can request a quote for 1-Bromo-2-ethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-ethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-ethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.