7H-Dibenz(DE,I)anthracen-7-one
TL;DR: 7H-Dibenz(DE,I)anthracen-7-one (CAS 5623-32-5) is a chemical compound with molecular formula C21H12O and molecular weight 280.0888 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentacyclo[11.7.1.02,11.04,9.017,21]henicosa-1(20),2,4,6,8,10,13,15,17(21),18-decaen-12-one
Also Known As: 7H-benzo[de]tetracen-7-one, 7H-DIBENZ(DE,I)ANTHRACEN-7-ONE, 7H-Benzo[de]naphthacen-7-one, 7H-Benzo[de]naphthacene-7-one, J1.560.598G
Technical Specifications
| Molecular Formula | C21H12O |
| Molecular Weight | 280.0888 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 280.0888 Da |
| Heavy Atoms | 22 |
| Complexity | 455.0 |
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC5=C4C(=CC=C5)C3=O |
| InChIKey | JEODYKPSBIYWJA-UHFFFAOYSA-N |
Chemical Property Profile of 7H-Dibenz(DE,I)anthracen-7-one
Property Insights of 7H-Dibenz(DE,I)anthracen-7-one
The XLogP value of 5.6 indicates that 7H-Dibenz(DE,I)anthracen-7-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, 7H-Dibenz(DE,I)anthracen-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7H-Dibenz(DE,I)anthracen-7-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 7H-Dibenz(DE,I)anthracen-7-one?
The CAS number of 7H-Dibenz(DE,I)anthracen-7-one is 5623-32-5.
What is the molecular formula of 7H-Dibenz(DE,I)anthracen-7-one?
The molecular formula of 7H-Dibenz(DE,I)anthracen-7-one is C21H12O.
What is the molecular weight of 7H-Dibenz(DE,I)anthracen-7-one?
The molecular weight of 7H-Dibenz(DE,I)anthracen-7-one is 280.0888 g/mol.
Where can I buy 7H-Dibenz(DE,I)anthracen-7-one?
You can request a quote for 7H-Dibenz(DE,I)anthracen-7-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7H-Dibenz(DE,I)anthracen-7-one?
Yes, CoreyChem provides custom synthesis services for 7H-Dibenz(DE,I)anthracen-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.