3,5-Dibromoaniline
TL;DR: 3,5-Dibromoaniline (CAS 79055-50-8) is a chemical compound with molecular formula C6H5Br2N and molecular weight 248.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dibromoaniline
Also Known As: 3,5-Dibromoaniline, 3,5-dibromanilin, 3,5-dibromophenylamine, 3-Nitrobenzamide, Benzenamine, 3,5-dibromo-
| Molecular Formula | C6H5Br2N |
|---|---|
| Molecular Weight | 248.88 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.87888 |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 79055-50-8 |
|---|---|
| SMILES | C1=C(C=C(C=C1Br)Br)N |
| InChIKey | RVNUUWJGSOHMRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dibromoaniline (CAS 79055-50-8), with molecular formula C6H5Br2N and molecular weight 248.88 g/mol. IUPAC: 3,5-dibromoaniline.
Chemical Property Profile of 3,5-Dibromoaniline
Property Insights of 3,5-Dibromoaniline
The XLogP value of 3.1 indicates that 3,5-Dibromoaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3,5-Dibromoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dibromoaniline 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 3,5-Dibromoaniline?
The CAS number of 3,5-Dibromoaniline is 79055-50-8.
What is the molecular formula of 3,5-Dibromoaniline?
The molecular formula of 3,5-Dibromoaniline is C6H5Br2N.
What is the molecular weight of 3,5-Dibromoaniline?
The molecular weight of 3,5-Dibromoaniline is 248.88 g/mol.
Where can I buy 3,5-Dibromoaniline?
You can request a quote for 3,5-Dibromoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dibromoaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dibromoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.