7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one
TL;DR: 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one (CAS 23203-49-8) is a chemical compound with molecular formula C13H16O2 and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one
Also Known As: 7-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one, 7-METHOXY-4,4-DIMETHYL-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE, 4,4-dimethyl-7-methoxy-1-tetralone, 7-Methoxy-4,4-dimethyl-3,4-dihydronaphthalen-1(2H)-one, 1(2H)-Naphthalenone,3,4-dihydro-7-methoxy-4,4-dimethyl-
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.11504 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 23203-49-8 |
|---|---|
| SMILES | CC1(CCC(=O)C2=C1C=CC(=C2)OC)C |
| InChIKey | XFUTWROAJKCYDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one (CAS 23203-49-8), with molecular formula C13H16O2 and molecular weight 204.12 g/mol. IUPAC: 7-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one.
Chemical Property Profile of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one
Property Insights of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one. With a topological polar surface area (TPSA) of 26.3 Ų, 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one has 0 hydrogen bond donor(s) and 2 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 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one?
The CAS number of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one is 23203-49-8.
What is the molecular formula of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one?
The molecular formula of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one is C13H16O2.
What is the molecular weight of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one?
The molecular weight of 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one is 204.12 g/mol.
Where can I buy 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one?
You can request a quote for 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.