![1-Bromobenzo[a]anthracene-7,12-dione structure](/static/products/7830/78302-28-0.webp)
1-Bromobenzo[a]anthracene-7,12-dione
TL;DR: 1-Bromobenzo[a]anthracene-7,12-dione (CAS 78302-28-0) is a chemical compound with molecular formula C18H9BrO2 and molecular weight 335.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromobenzo[a]anthracene-7,12-dione
Also Known As: 1-Bromotetraphene-7,12-dione, 1-bromobenzo[a]anthracene-7,12-dione
| Molecular Formula | C18H9BrO2 |
|---|---|
| Molecular Weight | 335.98 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 335.97858 |
| Heavy Atoms | 21 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 78302-28-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=CC=C4Br)C=C3 |
| InChIKey | DYGRLAHWVVQPJU-UHFFFAOYSA-N |
Product Overview
1-Bromobenzo[a]anthracene-7,12-dione (CAS 78302-28-0), with molecular formula C18H9BrO2 and molecular weight 335.98 g/mol. IUPAC: 1-bromobenzo[a]anthracene-7,12-dione.
Chemical Property Profile of 1-Bromobenzo[a]anthracene-7,12-dione
Property Insights of 1-Bromobenzo[a]anthracene-7,12-dione
The XLogP value of 4.8 indicates that 1-Bromobenzo[a]anthracene-7,12-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1-Bromobenzo[a]anthracene-7,12-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromobenzo[a]anthracene-7,12-dione 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-Bromobenzo[a]anthracene-7,12-dione?
The CAS number of 1-Bromobenzo[a]anthracene-7,12-dione is 78302-28-0.
What is the molecular formula of 1-Bromobenzo[a]anthracene-7,12-dione?
The molecular formula of 1-Bromobenzo[a]anthracene-7,12-dione is C18H9BrO2.
What is the molecular weight of 1-Bromobenzo[a]anthracene-7,12-dione?
The molecular weight of 1-Bromobenzo[a]anthracene-7,12-dione is 335.98 g/mol.
Where can I buy 1-Bromobenzo[a]anthracene-7,12-dione?
You can request a quote for 1-Bromobenzo[a]anthracene-7,12-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromobenzo[a]anthracene-7,12-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromobenzo[a]anthracene-7,12-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.