≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488184481 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488184481 |
| Canonical Smiles | CC1=CC(=CC(=C1)OC)C |
| IUPAC Name | 1-methoxy-3,5-dimethylbenzene |
| InChIKey | JCHJBEZBHANKGA-UHFFFAOYSA-N |
| INCHI | 1S/C9H12O/c1-7-4-8(2)6-9(5-7)10-3/h4-6H,1-3H3 |
| Isomeric SMILES | CC1=CC(=CC(=C1)OC)C |
| WGK Germany | 3 |
| Molecular Weight | 136.19 |
| Beilstein | 6(2)462 |
| Reaxy-Rn | 2040905 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2040905&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 | Phenol ethers |
| Subclass | Anisoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Anisoles |
| Alternative Parents | m-Xylenes Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenoxy compound - M-xylene - Xylene - Methoxybenzene - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof. |
| 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 |
|---|---|---|---|
 G2320527 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320534 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320539 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320542 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320543 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320547 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| G2320552 | Certificate of Analysis | Jun 20, 2023 | D155514 |
| L22081056 | Certificate of Analysis | Dec 23, 2022 | D155514 |
| D2307328 | Certificate of Analysis | Sep 21, 2022 | D155514 |
| L1805104 | Certificate of Analysis | Sep 21, 2022 | D155514 |
| F2330055 | Certificate of Analysis | Sep 21, 2022 | D155514 |
| L1805105 | Certificate of Analysis | Sep 21, 2022 | D155514 |
| Refractive Index | 1.51 |
|---|---|
| Flash Point(°F) | 150.8 °F |
| Flash Point(°C) | 65°C(lit.) |
| Boil Point(°C) | 193°C(lit.) |
| Molecular Weight | 136.190 g/mol |
| XLogP3 | 2.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 136.089 Da |
| Monoisotopic Mass | 136.089 Da |
| Topological Polar Surface Area | 9.200 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 90.900 |
| 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 |
| 1. Jingjing Zhang, Qingli Qian, Ying Wang, Bernard Baffour Asare Bediako, Jiang Yan, Buxing Han. (2019) Synthesis of ethanol from aryl methyl ether/lignin, CO2 and H2. Chemical Science, 10 (45): (10640-10646). [PMID:32110349] [10.1039/C9SC03386F] |
