Dibenz(a,j)anthracene
TL;DR: Dibenz(a,j)anthracene (CAS 224-41-9) is a chemical compound with molecular formula C22H14 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
Also Known As: Dibenz[a,j]anthracene, Dibenzo(a,j)anthracene, Benzo[m]tetraphene, Dibenzo(aj)anthracene, dibenz(aj)anthracene
| Molecular Formula | C22H14 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.10956 |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 224-41-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5=CC=CC=C5C=C4 |
| InChIKey | KLIHYVJAYWCEDM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenz(a,j)anthracene (CAS 224-41-9), with molecular formula C22H14 and molecular weight 278.11 g/mol. IUPAC: pentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene.
Chemical Property Profile of Dibenz(a,j)anthracene
Property Insights of Dibenz(a,j)anthracene
The XLogP value of 6.5 indicates that Dibenz(a,j)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dibenz(a,j)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(a,j)anthracene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibenz(a,j)anthracene?
The CAS number of Dibenz(a,j)anthracene is 224-41-9.
What is the molecular formula of Dibenz(a,j)anthracene?
The molecular formula of Dibenz(a,j)anthracene is C22H14.
What is the molecular weight of Dibenz(a,j)anthracene?
The molecular weight of Dibenz(a,j)anthracene is 278.11 g/mol.
Where can I buy Dibenz(a,j)anthracene?
You can request a quote for Dibenz(a,j)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenz(a,j)anthracene?
Yes, KEHONG BIO provides custom synthesis services for Dibenz(a,j)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.