Tricyclopentabenzene
TL;DR: Tricyclopentabenzene (CAS 1206-79-7) is a chemical compound with molecular formula C15H18 and molecular weight 198.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[e]-as-indacene
Also Known As: Tricyclopentabenzene, Trindan, Tricyclotrimethylenebenzene, 2,3,4,5,6,7,8,9-Octahydro-1H-trindene, tris(trimethylene)benzene
| Molecular Formula | C15H18 |
|---|---|
| Molecular Weight | 198.14 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.14085 |
| Heavy Atoms | 15 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 1206-79-7 |
|---|---|
| SMILES | C1CC2=C3CCCC3=C4CCCC4=C2C1 |
| InChIKey | KVUKOIJTLDNDDB-UHFFFAOYSA-N |
Product Overview
Tricyclopentabenzene (CAS 1206-79-7), with molecular formula C15H18 and molecular weight 198.14 g/mol. IUPAC: 2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[e]-as-indacene.
Chemical Property Profile of Tricyclopentabenzene
Property Insights of Tricyclopentabenzene
The XLogP value of 4.4 indicates that Tricyclopentabenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tricyclopentabenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tricyclopentabenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tricyclopentabenzene?
The CAS number of Tricyclopentabenzene is 1206-79-7.
What is the molecular formula of Tricyclopentabenzene?
The molecular formula of Tricyclopentabenzene is C15H18.
What is the molecular weight of Tricyclopentabenzene?
The molecular weight of Tricyclopentabenzene is 198.14 g/mol.
Where can I buy Tricyclopentabenzene?
You can request a quote for Tricyclopentabenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricyclopentabenzene?
Yes, KEHONG BIO provides custom synthesis services for Tricyclopentabenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.