![Benz[j]heptaphene structure](/static/products/2148/214-87-9.webp)
Benz[j]heptaphene
TL;DR: Benz[j]heptaphene (CAS 214-87-9) is a chemical compound with molecular formula C34H20 and molecular weight 428.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octacyclo[20.12.0.02,15.04,13.06,11.016,21.024,33.026,31]tetratriaconta-1(34),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32-heptadecaene
Also Known As: Benz[j]heptaphene, Benz(j)heptaphene, benzo[j]heptaphene, 7,8-Benzoheptaphen, 7,8-benzoheptaphene
| Molecular Formula | C34H20 |
|---|---|
| Molecular Weight | 428.16 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 428.1565 |
| Heavy Atoms | 34 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 214-87-9 |
|---|---|
| SMILES | C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C5=CC=CC=C5C6=CC7=CC8=CC=CC=C8C=C7C=C64 |
| InChIKey | IKWUOLSMNASVPR-UHFFFAOYSA-N |
Product Overview
Benz[j]heptaphene (CAS 214-87-9), with molecular formula C34H20 and molecular weight 428.16 g/mol. IUPAC: octacyclo[20.12.0.02,15.04,13.06,11.016,21.024,33.026,31]tetratriaconta-1(34),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32-heptadecaene.
Chemical Property Profile of Benz[j]heptaphene
Property Insights of Benz[j]heptaphene
The XLogP value of 9.3 indicates that Benz[j]heptaphene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benz[j]heptaphene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz[j]heptaphene 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 Benz[j]heptaphene?
The CAS number of Benz[j]heptaphene is 214-87-9.
What is the molecular formula of Benz[j]heptaphene?
The molecular formula of Benz[j]heptaphene is C34H20.
What is the molecular weight of Benz[j]heptaphene?
The molecular weight of Benz[j]heptaphene is 428.16 g/mol.
Where can I buy Benz[j]heptaphene?
You can request a quote for Benz[j]heptaphene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz[j]heptaphene?
Yes, KEHONG BIO provides custom synthesis services for Benz[j]heptaphene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.