Dibenzo(b,def)chrysene-7,14-dione
TL;DR: Dibenzo(b,def)chrysene-7,14-dione (CAS 128-66-5) is a chemical compound with molecular formula C24H12O2 and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1(23),2,4,6,9,11,13,15,17,20(24),21-undecaene-8,19-dione
Also Known As: Vat yellow 4, C.I. Vat Yellow 4, Tyrion Yellow, Yellow, Golden yellow
| Molecular Formula | C24H12O2 |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 332.08374 |
| Heavy Atoms | 26 |
| Complexity | 570.0 |
| Solubility | greater than or equal to 100 mg/mL at 75 °F (NTP, 1992) |
| Flash Point | greater than 93.3 °C |
Chemical Identifiers
| CAS Number | 128-66-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C(=O)C6=CC=CC=C65)C2=O |
| InChIKey | ZTWQZJLUUZHJGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzo(b,def)chrysene-7,14-dione (CAS 128-66-5), with molecular formula C24H12O2 and molecular weight 332.08 g/mol. IUPAC: hexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1(23),2,4,6,9,11,13,15,17,20(24),21-undecaene-8,19-dione.
Chemical Property Profile of Dibenzo(b,def)chrysene-7,14-dione
Property Insights of Dibenzo(b,def)chrysene-7,14-dione
The XLogP value of 5.4 indicates that Dibenzo(b,def)chrysene-7,14-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, Dibenzo(b,def)chrysene-7,14-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,def)chrysene-7,14-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibenzo(b,def)chrysene-7,14-dione?
The CAS number of Dibenzo(b,def)chrysene-7,14-dione is 128-66-5.
What is the molecular formula of Dibenzo(b,def)chrysene-7,14-dione?
The molecular formula of Dibenzo(b,def)chrysene-7,14-dione is C24H12O2.
What is the molecular weight of Dibenzo(b,def)chrysene-7,14-dione?
The molecular weight of Dibenzo(b,def)chrysene-7,14-dione is 332.08 g/mol.
Where can I buy Dibenzo(b,def)chrysene-7,14-dione?
You can request a quote for Dibenzo(b,def)chrysene-7,14-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,def)chrysene-7,14-dione?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,def)chrysene-7,14-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.