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Benz[a]anthracene-7,12-dione, 4-bromo-
TL;DR: Benz[a]anthracene-7,12-dione, 4-bromo- (CAS 63715-52-6) 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.
4-bromobenzo[a]anthracene-7,12-dione
Also Known As: Benz[a]anthracene-7,12-dione, 4-bromo-, 4-bromobenzo[a]anthracene-7,12-dione, Benz(a)anthracene-7,12-dione, 4-bromo-, 4-BROMOTETRAPHENE-7,12-DIONE, Benz[a]anthracene-7,12-dione,4-bromo-
| 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 | 63715-52-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)C(=CC=C4)Br |
| InChIKey | NXRTWAFFQRALPM-UHFFFAOYSA-N |
Product Overview
Benz[a]anthracene-7,12-dione, 4-bromo- (CAS 63715-52-6), with molecular formula C18H9BrO2 and molecular weight 335.98 g/mol. IUPAC: 4-bromobenzo[a]anthracene-7,12-dione.
Chemical Property Profile of Benz[a]anthracene-7,12-dione, 4-bromo-
Property Insights of Benz[a]anthracene-7,12-dione, 4-bromo-
The XLogP value of 4.8 indicates that Benz[a]anthracene-7,12-dione, 4-bromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Benz[a]anthracene-7,12-dione, 4-bromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz[a]anthracene-7,12-dione, 4-bromo- 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 Benz[a]anthracene-7,12-dione, 4-bromo-?
The CAS number of Benz[a]anthracene-7,12-dione, 4-bromo- is 63715-52-6.
What is the molecular formula of Benz[a]anthracene-7,12-dione, 4-bromo-?
The molecular formula of Benz[a]anthracene-7,12-dione, 4-bromo- is C18H9BrO2.
What is the molecular weight of Benz[a]anthracene-7,12-dione, 4-bromo-?
The molecular weight of Benz[a]anthracene-7,12-dione, 4-bromo- is 335.98 g/mol.
Where can I buy Benz[a]anthracene-7,12-dione, 4-bromo-?
You can request a quote for Benz[a]anthracene-7,12-dione, 4-bromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz[a]anthracene-7,12-dione, 4-bromo-?
Yes, KEHONG BIO provides custom synthesis services for Benz[a]anthracene-7,12-dione, 4-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.