4-Bromo-2-ethylaniline
TL;DR: 4-Bromo-2-ethylaniline (CAS 45762-41-2) is a chemical compound with molecular formula C8H10BrN and molecular weight 199.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-ethylaniline
Also Known As: 4-Bromo-2-ethylaniline, 2-Ethyl-4-bromoaniline, 4-Bromo-2-ethyl-aniline, Benzenamine, 4-bromo-2-ethyl-, 4-bromo-2-ethylbenzenamine
| Molecular Formula | C8H10BrN |
|---|---|
| Molecular Weight | 199.00 g/mol |
| LogP | 2.5937 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.99966 |
| Heavy Atoms | 10 |
| Complexity | 232.69925 |
Chemical Identifiers
| CAS Number | 45762-41-2 |
|---|---|
| SMILES | CCC1=C(C=CC(=C1)Br)N |
Product Overview
4-Bromo-2-ethylaniline (CAS 45762-41-2), with molecular formula C8H10BrN and molecular weight 199.00 g/mol. IUPAC: 4-bromo-2-ethylaniline.
Chemical Property Profile of 4-Bromo-2-ethylaniline
Property Insights of 4-Bromo-2-ethylaniline
The XLogP value of 2.5937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-ethylaniline. With a topological polar surface area (TPSA) of 26.02 Ų, 4-Bromo-2-ethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-ethylaniline has 1 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 4-Bromo-2-ethylaniline?
The CAS number of 4-Bromo-2-ethylaniline is 45762-41-2.
What is the molecular formula of 4-Bromo-2-ethylaniline?
The molecular formula of 4-Bromo-2-ethylaniline is C8H10BrN.
What is the molecular weight of 4-Bromo-2-ethylaniline?
The molecular weight of 4-Bromo-2-ethylaniline is 199.00 g/mol.
Where can I buy 4-Bromo-2-ethylaniline?
You can request a quote for 4-Bromo-2-ethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-ethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-ethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.