1-Azido-2-bromobenzene
TL;DR: 1-Azido-2-bromobenzene (CAS 3302-39-4) is a chemical compound with molecular formula C6H4BrN3 and molecular weight 196.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azido-2-bromobenzene
Also Known As: 1-Azido-2-bromobenzene, o-Bromophenyl azide, Bromphenylazide, 2-Bromophenyl azide, Benzene, 1-azido-2-bromo-
| Molecular Formula | C6H4BrN3 |
|---|---|
| Molecular Weight | 196.96 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 14.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.95886 |
| Heavy Atoms | 10 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 3302-39-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N=[N+]=[N-])Br |
| InChIKey | QOVQEONXPGQIHT-UHFFFAOYSA-N |
Product Overview
1-Azido-2-bromobenzene (CAS 3302-39-4), with molecular formula C6H4BrN3 and molecular weight 196.96 g/mol. IUPAC: 1-azido-2-bromobenzene.
Chemical Property Profile of 1-Azido-2-bromobenzene
Property Insights of 1-Azido-2-bromobenzene
The XLogP value of 3.5 indicates that 1-Azido-2-bromobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 14.4 Ų, 1-Azido-2-bromobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azido-2-bromobenzene has 0 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 1-Azido-2-bromobenzene?
The CAS number of 1-Azido-2-bromobenzene is 3302-39-4.
What is the molecular formula of 1-Azido-2-bromobenzene?
The molecular formula of 1-Azido-2-bromobenzene is C6H4BrN3.
What is the molecular weight of 1-Azido-2-bromobenzene?
The molecular weight of 1-Azido-2-bromobenzene is 196.96 g/mol.
Where can I buy 1-Azido-2-bromobenzene?
You can request a quote for 1-Azido-2-bromobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Azido-2-bromobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Azido-2-bromobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.