≥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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488183138 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183138 |
| Canonical Smiles | CC(=O)CC1=CC=C(C=C1)OC |
| IUPAC Name | 1-(4-methoxyphenyl)propan-2-one |
| InChIKey | WFWKNGZODAOLEO-UHFFFAOYSA-N |
| INCHI | 1S/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3 |
| Isomeric SMILES | CC(=O)CC1=CC=C(C=C1)OC |
| WGK Germany | 2 |
| RTECS | UC2990000 |
| Molecular Weight | 164.2 |
| Beilstein | 2044332 |
| Reaxy-Rn | 2044332 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2044332&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 | Benzene and substituted derivatives |
| Subclass | Phenylpropanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenylpropanes |
| Alternative Parents | Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Ketones Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenylpropane - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety. |
| 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 |
|---|---|---|---|
 F1826167 | Certificate of Analysis | Jan 27, 2026 | P102234 |
| L2106820 | Certificate of Analysis | Sep 09, 2025 | P102234 |
| L2106822 | Certificate of Analysis | Sep 09, 2025 | P102234 |
| A2509285 | Certificate of Analysis | Apr 30, 2024 | P102234 |
| A2509286 | Certificate of Analysis | Apr 30, 2024 | P102234 |
| A2509290 | Certificate of Analysis | Apr 30, 2024 | P102234 |
| C1911023 | Certificate of Analysis | Jan 04, 2023 | P102234 |
| Refractive Index | 1.525 |
|---|---|
| Flash Point(°F) | 215.6 °F |
| Flash Point(°C) | 101° |
| Boil Point(°C) | 145°C |
| Molecular Weight | 164.200 g/mol |
| XLogP3 | 1.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 164.084 Da |
| Monoisotopic Mass | 164.084 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 146.000 |
| 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 |
| 1. Yang Zhang, Jinchao Shen, Hong Yang, Yan Yang, Zhiguo Zhou, Shiping Yang. (2014) A highly selective magnetic sensor for Cd2+ in living cells with (Zn, Mn)-doped iron oxide nanoparticles. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:] [10.1016/j.snb.2014.10.074] |
| 2. Shuwei Wang, Tianyu Dong, Ruijia Liu, Jie Sun, Haitao Chen. (2025) Unraveling the off-flavor compounds and key spice compounds in pork broth and their interaction mechanisms. JOURNAL OF FOOD COMPOSITION AND ANALYSIS, [PMID:] [10.1016/j.jfca.2025.108248] |
