9-(1,1-Dimethylethyl)-9H-fluorene
TL;DR: 9-(1,1-Dimethylethyl)-9H-fluorene (CAS 17114-78-2) is a chemical compound with molecular formula C17H18 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-tert-butyl-9H-fluorene
Also Known As: 9-tert-butyl-9H-fluorene, 9-t-butylfluorene, 9-tert-butylfluorene, 9-tert-butyl-fluorene, 9-(1,1-DIMETHYLETHYL)-9H-FLUORENE
| Molecular Formula | C17H18 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.14085 |
| Heavy Atoms | 17 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 17114-78-2 |
|---|---|
| SMILES | CC(C)(C)C1C2=CC=CC=C2C3=CC=CC=C13 |
| InChIKey | FGGPKIIPWXUABP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-(1,1-Dimethylethyl)-9H-fluorene (CAS 17114-78-2), with molecular formula C17H18 and molecular weight 222.14 g/mol. IUPAC: 9-tert-butyl-9H-fluorene.
Chemical Property Profile of 9-(1,1-Dimethylethyl)-9H-fluorene
Property Insights of 9-(1,1-Dimethylethyl)-9H-fluorene
The XLogP value of 5.1 indicates that 9-(1,1-Dimethylethyl)-9H-fluorene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 9-(1,1-Dimethylethyl)-9H-fluorene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-(1,1-Dimethylethyl)-9H-fluorene 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 9-(1,1-Dimethylethyl)-9H-fluorene?
The CAS number of 9-(1,1-Dimethylethyl)-9H-fluorene is 17114-78-2.
What is the molecular formula of 9-(1,1-Dimethylethyl)-9H-fluorene?
The molecular formula of 9-(1,1-Dimethylethyl)-9H-fluorene is C17H18.
What is the molecular weight of 9-(1,1-Dimethylethyl)-9H-fluorene?
The molecular weight of 9-(1,1-Dimethylethyl)-9H-fluorene is 222.14 g/mol.
Where can I buy 9-(1,1-Dimethylethyl)-9H-fluorene?
You can request a quote for 9-(1,1-Dimethylethyl)-9H-fluorene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(1,1-Dimethylethyl)-9H-fluorene?
Yes, KEHONG BIO provides custom synthesis services for 9-(1,1-Dimethylethyl)-9H-fluorene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.