2-Bromo-1h-phenalen-1-one
TL;DR: 2-Bromo-1h-phenalen-1-one (CAS 33693-84-4) is a chemical compound with molecular formula C13H7BrO and molecular weight 257.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromophenalen-1-one
Also Known As: 2-bromo-1h-phenalen-1-one, 2-bromophenalen-1-one, 2-Brom-perinaphthenon, 2-bromo-1-phenalenone, 2-bromanylphenalen-1-one
| Molecular Formula | C13H7BrO |
|---|---|
| Molecular Weight | 257.97 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 257.96802 |
| Heavy Atoms | 15 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 33693-84-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=C(C(=O)C3=CC=C2)Br |
| InChIKey | ZGECPZHXUNAVFE-UHFFFAOYSA-N |
Product Overview
2-Bromo-1h-phenalen-1-one (CAS 33693-84-4), with molecular formula C13H7BrO and molecular weight 257.97 g/mol. IUPAC: 2-bromophenalen-1-one.
Chemical Property Profile of 2-Bromo-1h-phenalen-1-one
Property Insights of 2-Bromo-1h-phenalen-1-one
The XLogP value of 4.1 indicates that 2-Bromo-1h-phenalen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Bromo-1h-phenalen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1h-phenalen-1-one has 0 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 2-Bromo-1h-phenalen-1-one?
The CAS number of 2-Bromo-1h-phenalen-1-one is 33693-84-4.
What is the molecular formula of 2-Bromo-1h-phenalen-1-one?
The molecular formula of 2-Bromo-1h-phenalen-1-one is C13H7BrO.
What is the molecular weight of 2-Bromo-1h-phenalen-1-one?
The molecular weight of 2-Bromo-1h-phenalen-1-one is 257.97 g/mol.
Where can I buy 2-Bromo-1h-phenalen-1-one?
You can request a quote for 2-Bromo-1h-phenalen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1h-phenalen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1h-phenalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.