≥97%(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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488181191 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181191 |
| Canonical Smiles | CC1=CC=C(C=C1)C(C)O |
| IUPAC Name | 1-(4-methylphenyl)ethanol |
| InChIKey | JESIHYIJKKUWIS-UHFFFAOYSA-N |
| INCHI | 1S/C9H12O/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8,10H,1-2H3 |
| Isomeric SMILES | CC1=CC=C(C=C1)C(C)O |
| WGK Germany | 2 |
| RTECS | DO4565000 |
| PubChem CID | 10817 |
| Molecular Weight | 136.19 |
| Beilstein | 1857560 |
| Reaxy-Rn | 1857562 |
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 | Toluenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Toluenes |
| Alternative Parents | Secondary alcohols Hydrocarbon derivatives Aromatic alcohols |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Toluene - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group. |
| 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 |
|---|---|---|---|
 D2621660 | Certificate of Analysis | Apr 30, 2026 | P160711 |
| D2621676 | Certificate of Analysis | Apr 30, 2026 | P160711 |
| D2621677 | Certificate of Analysis | Apr 30, 2026 | P160711 |
| D2621678 | Certificate of Analysis | Apr 30, 2026 | P160711 |
| L2117242 | Certificate of Analysis | Oct 11, 2025 | P160711 |
| L2117393 | Certificate of Analysis | Oct 11, 2025 | P160711 |
| L2117394 | Certificate of Analysis | Oct 11, 2025 | P160711 |
| K2505691 | Certificate of Analysis | Jul 02, 2024 | P160711 |
| Solubility | Slightly miscible with water. |
|---|---|
| Refractive Index | 1.52 |
| Flash Point(°F) | 224.6 °F |
| Flash Point(°C) | 107°C(lit.) |
| Boil Point(°C) | 218-220°C |
| Molecular Weight | 136.190 g/mol |
| XLogP3 | 1.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 136.089 Da |
| Monoisotopic Mass | 136.089 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 92.900 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Tong Li, Hui Li, Jia Chen, Yongliang Yu, Shuai Chen, Jianhua Wang, Hongdeng Qiu. (2024) Histidine-modified pillar[5]arene-functionalized mesoporous silica materials for highly selective enantioseparation. JOURNAL OF CHROMATOGRAPHY A, [PMID:38776604] [10.1016/j.chroma.2024.465011] |
| 2. Dehao Meng, Dongbo Zhao, Zhichao Zhao, Xiaoxue Wang, Yi Wu, Yonghui Li, Zhaolin Lv, Qilin Zhong. (2025) Revealing key aroma compounds and the potential metabolic pathways in sea buckthorn berries. FOOD CHEMISTRY, [PMID:39986073] [10.1016/j.foodchem.2025.143430] |
