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Basic Description
| Synonyms | 7-methoxy-3,4-dihydro-2H-naphthalen-1-one | 7-methoxytetralone | 7-methoxy-tetralone | HY-W001925 | 7-methoxy-1,2,3,4-tetrahydro-1-naphthalenone | 7-methoxyl-1-tetralone | M2092 | BCP33967 | DG-0040 | NSC 97611 | 7-methoxy-1-tetraione | DTXSID30218494 | 6 |
|---|---|
| Specifications & Purity | ≥99% |
| Shipped In | Normal |
| Product Description |
Application 7-methoxy-1-tetralone was used in the synthesis of 2,7-dimethoxy-1-tetralone, substituted derivatives of 3a,4,5,6-tetrahydrosuccinimido[3,4-b]acenaphthen-10-one and 13H-benzo[6-7]indolo[3,2-c]quinolines. |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
- Class Tetralins
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Tetralins |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Tetralins |
| Alternative Parents | Aryl alkyl ketones Anisoles Alkyl aryl ethers Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Tetralin - Aryl alkyl ketone - Aryl ketone - Anisole - Alkyl aryl ether - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane. |
| External Descriptors | Not available |
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Associated Targets(Human)
HepG2 (196354 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
|---|
Names and Identifiers
| Pubchem Sid | 488185944 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488185944 |
| IUPAC Name | 7-methoxy-3,4-dihydro-2H-naphthalen-1-one |
| INCHI | InChI=1S/C11H12O2/c1-13-9-6-5-8-3-2-4-11(12)10(8)7-9/h5-7H,2-4H2,1H3 |
| InChIKey | GABLTKRIYDNDIN-UHFFFAOYSA-N |
| Smiles | COC1=CC2=C(CCCC2=O)C=C1 |
| Isomeric SMILES | COC1=CC2=C(CCCC2=O)C=C1 |
| WGK Germany | 3 |
| Molecular Weight | 176.21 |
| Beilstein | 2208389 |
| Reaxy-Rn | 2208389 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2208389&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 L1225082 |
Certificate of Analysis | Sep 12, 2024 | M119779 |
| A2419465 |
Certificate of Analysis | Nov 24, 2023 | M119779 |
| D2319531 |
Certificate of Analysis | Apr 27, 2023 | M119779 |
| A2316021 |
Certificate of Analysis | Jan 30, 2023 | M119779 |
| L2202206 |
Certificate of Analysis | Oct 09, 2022 | M119779 |
| L2202191 |
Certificate of Analysis | Oct 09, 2022 | M119779 |
| L2202189 |
Certificate of Analysis | Oct 09, 2022 | M119779 |
| D2319544 |
Certificate of Analysis | Feb 10, 2022 | M119779 |
| C2219032 |
Certificate of Analysis | Feb 10, 2022 | M119779 |
| C2219030 |
Certificate of Analysis | Feb 10, 2022 | M119779 |
| C2219043 |
Certificate of Analysis | Feb 10, 2022 | M119779 |
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Chemical and Physical Properties
| Melt Point(°C) | 60-64°C |
|---|---|
| Molecular Weight | 176.210 g/mol |
| XLogP3 | 2.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 176.084 Da |
| Monoisotopic Mass | 176.084 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 200.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Solution Calculators
Reviews
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