4H-Cyclopenta(def)chrysene
TL;DR: 4H-Cyclopenta(def)chrysene (CAS 202-98-2) is a chemical compound with molecular formula C19H12 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentacyclo[14.2.1.03,8.09,18.012,17]nonadeca-1,3,5,7,9(18),10,12(17),13,15-nonaene
Also Known As: 4,5-Methanochrysene, 4H-Cyclopenta(def)chrysene, 4H-Cyclopenta[def]chrysene, 4,5-Methylenechrysene, Chrysene, 4,5-methylene-
| Molecular Formula | C19H12 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.0939 |
| Heavy Atoms | 19 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 202-98-2 |
|---|---|
| SMILES | C1C2=CC=CC3=C2C4=C(C=C3)C5=CC=CC=C5C=C41 |
| InChIKey | GTDQLJVKXFXBMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-Cyclopenta(def)chrysene (CAS 202-98-2), with molecular formula C19H12 and molecular weight 240.09 g/mol. IUPAC: pentacyclo[14.2.1.03,8.09,18.012,17]nonadeca-1,3,5,7,9(18),10,12(17),13,15-nonaene.
Chemical Property Profile of 4H-Cyclopenta(def)chrysene
Property Insights of 4H-Cyclopenta(def)chrysene
The XLogP value of 5.7 indicates that 4H-Cyclopenta(def)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-Cyclopenta(def)chrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Cyclopenta(def)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-Cyclopenta(def)chrysene?
The CAS number of 4H-Cyclopenta(def)chrysene is 202-98-2.
What is the molecular formula of 4H-Cyclopenta(def)chrysene?
The molecular formula of 4H-Cyclopenta(def)chrysene is C19H12.
What is the molecular weight of 4H-Cyclopenta(def)chrysene?
The molecular weight of 4H-Cyclopenta(def)chrysene is 240.09 g/mol.
Where can I buy 4H-Cyclopenta(def)chrysene?
You can request a quote for 4H-Cyclopenta(def)chrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Cyclopenta(def)chrysene?
Yes, KEHONG BIO provides custom synthesis services for 4H-Cyclopenta(def)chrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.