4H-Benzo(def)cyclopenta(mno)chrysene
TL;DR: 4H-Benzo(def)cyclopenta(mno)chrysene (CAS 59004-72-7) is a chemical compound with molecular formula C21H12 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexacyclo[10.7.1.14,19.02,10.03,8.016,20]henicosa-1,3,6,8,10,12,14,16(20),17,19(21)-decaene
Also Known As: 4H-Benzo(def)cyclopenta(mno)chrysene, 1H-indeno[2,1,7,6,5-nopqr]tetraphene
| Molecular Formula | C21H12 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.0939 |
| Heavy Atoms | 21 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 59004-72-7 |
|---|---|
| SMILES | C1C=CC2=CC3=CC4=CC=CC5=C4C6=C3C2=C1C=C6C=C5 |
| InChIKey | OWBODVGMQFKHES-UHFFFAOYSA-N |
Product Overview
4H-Benzo(def)cyclopenta(mno)chrysene (CAS 59004-72-7), with molecular formula C21H12 and molecular weight 264.09 g/mol. IUPAC: hexacyclo[10.7.1.14,19.02,10.03,8.016,20]henicosa-1,3,6,8,10,12,14,16(20),17,19(21)-decaene.
Chemical Property Profile of 4H-Benzo(def)cyclopenta(mno)chrysene
Property Insights of 4H-Benzo(def)cyclopenta(mno)chrysene
The XLogP value of 5.9 indicates that 4H-Benzo(def)cyclopenta(mno)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, 4H-Benzo(def)cyclopenta(mno)chrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Benzo(def)cyclopenta(mno)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 4H-Benzo(def)cyclopenta(mno)chrysene?
The CAS number of 4H-Benzo(def)cyclopenta(mno)chrysene is 59004-72-7.
What is the molecular formula of 4H-Benzo(def)cyclopenta(mno)chrysene?
The molecular formula of 4H-Benzo(def)cyclopenta(mno)chrysene is C21H12.
What is the molecular weight of 4H-Benzo(def)cyclopenta(mno)chrysene?
The molecular weight of 4H-Benzo(def)cyclopenta(mno)chrysene is 264.09 g/mol.
Where can I buy 4H-Benzo(def)cyclopenta(mno)chrysene?
You can request a quote for 4H-Benzo(def)cyclopenta(mno)chrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Benzo(def)cyclopenta(mno)chrysene?
Yes, KEHONG BIO provides custom synthesis services for 4H-Benzo(def)cyclopenta(mno)chrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.