1-Bromo-3-nitroazulene
TL;DR: 1-Bromo-3-nitroazulene (CAS 41321-60-2) is a chemical compound with molecular formula C10H6BrNO2 and molecular weight 250.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-nitroazulene
Also Known As: 1-bromo-3-nitroazulene, 1-Nitro-3-bromoazulen, Azulene, 1-bromo-3-nitro-, 3-bromo-1-nitro-azulene
| Molecular Formula | C10H6BrNO2 |
|---|---|
| Molecular Weight | 250.96 g/mol |
| LogP | 3.4621 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.95819 |
| Heavy Atoms | 14 |
| Complexity | 469.9303 |
Chemical Identifiers
| CAS Number | 41321-60-2 |
|---|---|
| SMILES | C1=CC=C2C(=C(C=C2[N+](=O)[O-])Br)C=C1 |
Product Overview
1-Bromo-3-nitroazulene (CAS 41321-60-2), with molecular formula C10H6BrNO2 and molecular weight 250.96 g/mol. IUPAC: 1-bromo-3-nitroazulene.
Chemical Property Profile of 1-Bromo-3-nitroazulene
Property Insights of 1-Bromo-3-nitroazulene
The XLogP value of 3.4621 indicates that 1-Bromo-3-nitroazulene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, 1-Bromo-3-nitroazulene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3-nitroazulene 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-Bromo-3-nitroazulene?
The CAS number of 1-Bromo-3-nitroazulene is 41321-60-2.
What is the molecular formula of 1-Bromo-3-nitroazulene?
The molecular formula of 1-Bromo-3-nitroazulene is C10H6BrNO2.
What is the molecular weight of 1-Bromo-3-nitroazulene?
The molecular weight of 1-Bromo-3-nitroazulene is 250.96 g/mol.
Where can I buy 1-Bromo-3-nitroazulene?
You can request a quote for 1-Bromo-3-nitroazulene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-3-nitroazulene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3-nitroazulene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.