≥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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504757574 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504757574 |
| Canonical Smiles | CN(C)CCC1=CC=C(C=C1)O.Cl |
| IUPAC Name | 4-[2-(dimethylamino)ethyl]phenol;hydrochloride |
| InChIKey | KIZRJFIRFPIRFS-UHFFFAOYSA-N |
| INCHI | 1S/C10H15NO.ClH/c1-11(2)8-7-9-3-5-10(12)6-4-9;/h3-6,12H,7-8H2,1-2H3;1H |
| Isomeric SMILES | CN(C)CCC1=CC=C(C=C1)O.Cl |
| Molecular Weight | 201.69 |
| Reaxy-Rn | 3696703 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3696703&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 | Phenethylamines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenethylamines |
| Alternative Parents | Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Trialkylamines Organopnictogen compounds Organooxygen compounds Hydrochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenethylamine - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Tertiary aliphatic amine - Tertiary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine. |
| 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 |
|---|---|---|---|
 I2328436 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328437 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328438 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328439 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328440 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328441 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328442 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| I2328443 | Certificate of Analysis | Sep 05, 2023 | H194142 |
| Sensitivity | Moisture sensitive |
|---|---|
| Melt Point(°C) | 177-180°C |
| Molecular Weight | 201.690 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 201.092 Da |
| Monoisotopic Mass | 201.092 Da |
| Topological Polar Surface Area | 23.500 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 117.000 |
| 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 | 2 |
