| Pubchem Sid | 504755211 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504755211 |
| Canonical Smiles | COC1=CC2=C(CCC(=O)C2)C=C1 |
| IUPAC Name | 7-methoxy-3,4-dihydro-1H-naphthalen-2-one |
| InChIKey | XEAPZXNZOJGVCZ-UHFFFAOYSA-N |
| INCHI | 1S/C11H12O2/c1-13-11-5-3-8-2-4-10(12)6-9(8)7-11/h3,5,7H,2,4,6H2,1H3 |
| Isomeric SMILES | COC1=CC2=C(CCC(=O)C2)C=C1 |
| WGK Germany | 3 |
| Molecular Weight | 176.22 |
| Beilstein | 1953200 |
| Reaxy-Rn | 1953198 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1953198&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Tetralins |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Tetralins |
| Alternative Parents | Anisoles Alkyl aryl ethers Cyclic ketones Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Tetralin - Anisole - Alkyl aryl ether - Cyclic ketone - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 F2205231 | Certificate of Analysis | Dec 12, 2025 | M119742 |
| F2205236 | Certificate of Analysis | Dec 12, 2025 | M119742 |
| F2205237 | Certificate of Analysis | Dec 12, 2025 | M119742 |
| F2205360 | Certificate of Analysis | Dec 12, 2025 | M119742 |
| K2526138 | Certificate of Analysis | Dec 01, 2025 | M119742 |
| Sensitivity | Heat sensitive |
|---|---|
| Refractive Index | 1.5595 |
| Flash Point(°F) | >235.4 °F |
| Boil Point(°C) | 124-126°C/1.5mmHg |
| Melt Point(°C) | 27 °C |
| Molecular Weight | 176.210 g/mol |
| XLogP3 | 1.600 |
| 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 |
