8-Ethyl-3,4-dihydronaphthalen-1(2H)-one
TL;DR: 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one (CAS 110432-67-2) 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.
8-ethyl-3,4-dihydro-2H-naphthalen-1-one
Also Known As: 8-Ethyltetralin-1-one, 8-Ethyl-1-tetralone, 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one, Naphthalenone, 8-ethyl-3,4-dihydro-, 8-ethyl-1,2,3,4-tetrahydronaphthalen-1-one
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 110432-67-2 |
|---|---|
| SMILES | CCC1=CC=CC2=C1C(=O)CCC2 |
| InChIKey | HKXFCRSELMMVAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-Ethyl-3,4-dihydronaphthalen-1(2H)-one (CAS 110432-67-2), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 8-ethyl-3,4-dihydro-2H-naphthalen-1-one.
Chemical Property Profile of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one
Property Insights of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one. With a topological polar surface area (TPSA) of 17.1 Ų, 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Ethyl-3,4-dihydronaphthalen-1(2H)-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 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one?
The CAS number of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one is 110432-67-2.
What is the molecular formula of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one?
The molecular formula of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one is C12H14O.
What is the molecular weight of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one?
The molecular weight of 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one is 174.10 g/mol.
Where can I buy 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one?
You can request a quote for 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Ethyl-3,4-dihydronaphthalen-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.