![5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one structure](/static/products/842/84211-47-2.png)
5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one
TL;DR: 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one (CAS 84211-47-2) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8,9,10-tetrahydro-6H-benzo[8]annulen-5-one
Also Known As: 7,8,9,10-tetrahydrobenzo[8]annulen-5(6h)-one, SEKQECDUSDIAPN-UHFFFAOYSA-, 7,8,9,10-tetrahydro-6H-benzo[8]annulen-5-one, 7,8,9,10-tetrahydro-6H-benzocycloocten-5-one, 5,6,7,8,9,10-hexahydrobenzo[8]annulen-5-one
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 84211-47-2 |
|---|---|
| SMILES | C1CCC2=CC=CC=C2C(=O)CC1 |
| InChIKey | SEKQECDUSDIAPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one (CAS 84211-47-2), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 7,8,9,10-tetrahydro-6H-benzo[8]annulen-5-one.
Chemical Property Profile of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one
Property Insights of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one
The XLogP value of 3.1 indicates that 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one has 0 hydrogen bond donor(s) and 1 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 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one?
The CAS number of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one is 84211-47-2.
What is the molecular formula of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one?
The molecular formula of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one is C12H14O.
What is the molecular weight of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one?
The molecular weight of 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one is 174.10 g/mol.
Where can I buy 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one?
You can request a quote for 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8,9,10-Hexahydrobenzo[8]annulen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.