≥98% 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
It can be used the synthesis of 1-Methoxy-4-ethyl-1,4-cyclohexadiene. It is also applied in the ligand-assisted, copper-catalyzed enantioselective benzylic amination.
| Pubchem Sid | 488184788 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488184788 |
| Canonical Smiles | CCC1=CC=C(C=C1)OC |
| IUPAC Name | 1-ethyl-4-methoxybenzene |
| InChIKey | HDNRAPAFJLXKBV-UHFFFAOYSA-N |
| INCHI | 1S/C9H12O/c1-3-8-4-6-9(10-2)7-5-8/h4-7H,3H2,1-2H3 |
| Isomeric SMILES | CCC1=CC=C(C=C1)OC |
| Molecular Weight | 136.19 |
| Beilstein | 6(4)3021 |
| Reaxy-Rn | 774365 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774365&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 | Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenoxy compound - 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 |
|---|---|---|---|
 I2201417 | Certificate of Analysis | Mar 11, 2026 | E137475 |
| I2201445 | Certificate of Analysis | Mar 11, 2026 | E137475 |
| I2511154 | Certificate of Analysis | Sep 13, 2025 | E137475 |
| K2320032 | Certificate of Analysis | Sep 04, 2025 | E137475 |
| G2523075 | Certificate of Analysis | Jul 26, 2025 | E137475 |
| G2308140 | Certificate of Analysis | Apr 18, 2025 | E137475 |
| G2401079 | Certificate of Analysis | Jul 05, 2024 | E137475 |
| B1601015 | Certificate of Analysis | Jun 08, 2023 | E137475 |
| Solubility | Soluble in alcohol. Insoluble in water. |
|---|---|
| Refractive Index | 1.51 |
| Flash Point(°F) | 174°F |
| Flash Point(°C) | 79°C |
| Boil Point(°C) | 195 °C |
| Molecular Weight | 136.190 g/mol |
| XLogP3 | 3.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| 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 | 82.700 |
| 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. Liyun Huang, Kui Wu, Qian He, Chao Xiong, Tao Gan, Xiaohui He, Hongbing Ji. (2021) Quasi-continuous synthesis of iron single atom catalysts via a microcapsule pyrolysis strategy. AICHE JOURNAL, 67 (6): (e17197). [PMID:] [10.1002/aic.17197] |
| 2. Xinjun He, Mengqiao Gao, Fukun Li, Zhiyang Tang, Jie Qu, Jinxing Long, Qiang Zeng, Xuehui Li. (2025) Catalytic hydrogenolysis of lignin under syngas: the enhancement on the Cβ-O bond cleavage with CO. GREEN CHEMISTRY, [PMID:] [10.1039/D5GC01618E] |
| 3. Guo-Shan Zhu, Ren-Jie Hui, Jun Hu. (2025) Microdroplet Stabilization Enabled Direct Mass Spectrometric Identification of Electrogenerated Transient Carbocation Intermediates. Advanced Science, [PMID:41355586] [10.1002/advs.202518157] |
