Benzo(pqr)picene
TL;DR: Benzo(pqr)picene (CAS 189-96-8) is a chemical compound with molecular formula C24H14 and molecular weight 302.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexacyclo[14.6.2.02,11.05,10.013,23.020,24]tetracosa-1(23),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene
Also Known As: benzo[pqr]picene, BENZO(PQR)PICENE, naphtho[2,1-a]pyrene, Naphtho(2,1-a)pyrene, Naphtho(3',4':3,4)pyrene
| Molecular Formula | C24H14 |
|---|---|
| Molecular Weight | 302.11 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 302.10956 |
| Heavy Atoms | 24 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 189-96-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C6C4=C3C=CC6=CC=C5 |
| InChIKey | VOIIGLOUBINLKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzo(pqr)picene (CAS 189-96-8), with molecular formula C24H14 and molecular weight 302.11 g/mol. IUPAC: hexacyclo[14.6.2.02,11.05,10.013,23.020,24]tetracosa-1(23),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene.
Chemical Property Profile of Benzo(pqr)picene
Property Insights of Benzo(pqr)picene
The XLogP value of 7.2 indicates that Benzo(pqr)picene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzo(pqr)picene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(pqr)picene 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 Benzo(pqr)picene?
The CAS number of Benzo(pqr)picene is 189-96-8.
What is the molecular formula of Benzo(pqr)picene?
The molecular formula of Benzo(pqr)picene is C24H14.
What is the molecular weight of Benzo(pqr)picene?
The molecular weight of Benzo(pqr)picene is 302.11 g/mol.
Where can I buy Benzo(pqr)picene?
You can request a quote for Benzo(pqr)picene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(pqr)picene?
Yes, KEHONG BIO provides custom synthesis services for Benzo(pqr)picene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.