Dibenzo(b,k)Chrysene
TL;DR: Dibenzo(b,k)Chrysene (CAS 217-54-9) is a chemical compound with molecular formula C26H16 and molecular weight 328.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexacyclo[12.12.0.02,11.04,9.015,24.017,22]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene
Also Known As: Dibenzo[b,k]chrysene, Anth(2,1-a)anthrene, DIBENZO(B,K)CHRYSENE, Dibenzo<,k>chrysene, Anth(2,1a)anthrene
| Molecular Formula | C26H16 |
|---|---|
| Molecular Weight | 328.13 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 328.1252 |
| Heavy Atoms | 26 |
| Complexity | 462.0 |
| Melting Point | 400 °C |
Chemical Identifiers
| CAS Number | 217-54-9 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC5=CC6=CC=CC=C6C=C54 |
| InChIKey | DHCSBRKYHMINPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzo(b,k)Chrysene (CAS 217-54-9), with molecular formula C26H16 and molecular weight 328.13 g/mol. IUPAC: hexacyclo[12.12.0.02,11.04,9.015,24.017,22]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene.
Chemical Property Profile of Dibenzo(b,k)Chrysene
Property Insights of Dibenzo(b,k)Chrysene
The XLogP value of 7.6 indicates that Dibenzo(b,k)Chrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dibenzo(b,k)Chrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,k)Chrysene 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 Dibenzo(b,k)Chrysene?
The CAS number of Dibenzo(b,k)Chrysene is 217-54-9.
What is the molecular formula of Dibenzo(b,k)Chrysene?
The molecular formula of Dibenzo(b,k)Chrysene is C26H16.
What is the molecular weight of Dibenzo(b,k)Chrysene?
The molecular weight of Dibenzo(b,k)Chrysene is 328.13 g/mol.
Where can I buy Dibenzo(b,k)Chrysene?
You can request a quote for Dibenzo(b,k)Chrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,k)Chrysene?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,k)Chrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.