2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one
TL;DR: 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one (CAS 91900-06-0) is a chemical compound with molecular formula C13H14O and molecular weight 186.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,4a,9a-hexahydrofluoren-9-one
Also Known As: 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one, 9-Fluorenone, trans-hexahydrofluorenone, 1,2,3,4,4a,9a-hexahydrofluoren-9-one, 1,2,3,4,4a,9a-Hexahydro-9H-fluoren-9-one
| Molecular Formula | C13H14O |
|---|---|
| Molecular Weight | 186.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.10446 |
| Heavy Atoms | 14 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 91900-06-0 |
|---|---|
| SMILES | C1CCC2C(C1)C3=CC=CC=C3C2=O |
| InChIKey | MOLIPKPQUNOLPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one (CAS 91900-06-0), with molecular formula C13H14O and molecular weight 186.10 g/mol. IUPAC: 1,2,3,4,4a,9a-hexahydrofluoren-9-one.
Chemical Property Profile of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one
Property Insights of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one
The XLogP value of 3.2 indicates that 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-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, 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-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 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one?
The CAS number of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one is 91900-06-0.
What is the molecular formula of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one?
The molecular formula of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one is C13H14O.
What is the molecular weight of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one?
The molecular weight of 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one is 186.10 g/mol.
Where can I buy 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one?
You can request a quote for 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,4a-Tetrahydro-1H-fluoren-9(9aH)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.