4-(2-Bromoethoxy)aniline
TL;DR: 4-(2-Bromoethoxy)aniline (CAS 116755-59-0) is a chemical compound with molecular formula C8H10BrNO and molecular weight 214.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromoethoxy)aniline
Also Known As: 4-(2-bromoethoxy)aniline, beta-Bromo-p-phenetidine, 2-Bromoethyl 4-aminophenyl ether, 4-(2-BROMOETHOXY)BENZENAMINE, J3.368.881D
| Molecular Formula | C8H10BrNO |
|---|---|
| Molecular Weight | 214.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.99458 |
| Heavy Atoms | 11 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 116755-59-0 |
|---|---|
| SMILES | C1=CC(=CC=C1N)OCCBr |
| InChIKey | GRWGPHWXWQLOFK-UHFFFAOYSA-N |
Product Overview
4-(2-Bromoethoxy)aniline (CAS 116755-59-0), with molecular formula C8H10BrNO and molecular weight 214.99 g/mol. IUPAC: 4-(2-bromoethoxy)aniline.
Chemical Property Profile of 4-(2-Bromoethoxy)aniline
Property Insights of 4-(2-Bromoethoxy)aniline
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Bromoethoxy)aniline. With a topological polar surface area (TPSA) of 35.3 Ų, 4-(2-Bromoethoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Bromoethoxy)aniline has 1 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 4-(2-Bromoethoxy)aniline?
The CAS number of 4-(2-Bromoethoxy)aniline is 116755-59-0.
What is the molecular formula of 4-(2-Bromoethoxy)aniline?
The molecular formula of 4-(2-Bromoethoxy)aniline is C8H10BrNO.
What is the molecular weight of 4-(2-Bromoethoxy)aniline?
The molecular weight of 4-(2-Bromoethoxy)aniline is 214.99 g/mol.
Where can I buy 4-(2-Bromoethoxy)aniline?
You can request a quote for 4-(2-Bromoethoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Bromoethoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Bromoethoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.