≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged Ships Wet ice 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.
| Canonical Smiles | CCCCCCCCCCCCC1=CC=C(C=C1)O |
|---|---|
| IUPAC Name | 4-dodecylphenol |
| InChIKey | KJWMCPYEODZESQ-UHFFFAOYSA-N |
| INCHI | 1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h13-16,19H,2-12H2,1H3 |
| Isomeric SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)O |
| UN Number | 2430 |
| Packing Group | III |
| Molecular Weight | 262.44 |
| Reaxy-Rn | 1962860 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1962860&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 | Phenols |
| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
| Alternative Parents | Benzene and substituted derivatives Organooxygen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as 1-hydroxy-2-unsubstituted benzenoids. These are phenols that a unsubstituted at the 2-position. |
| External Descriptors | phenols |
| Sensitivity | Air Sensitive |
|---|---|
| Boil Point(°C) | 175 °C/2 mmHg |
| Melt Point(°C) | 66 °C |
| Molecular Weight | 262.400 g/mol |
| XLogP3 | 7.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 11 |
| Exact Mass | 262.23 Da |
| Monoisotopic Mass | 262.23 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 182.000 |
| 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. Shanshan Liu, Qibin Chen, Yujie Sheng, Jincheng Shen, Changjun Peng, Honglai Liu. (2015) Unraveling the forming mechanism of hierarchical helices via self-assembly of an achiral supramolecular polymer brush. Polymer Chemistry, 6 (21): (3926-3933). [PMID:] [10.1039/C5PY00163C] |
