Determine the necessary mass, volume, or concentration for preparing a solution.
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≥97%(GC)(T) 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.
| Pubchem Sid | 504752139 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752139 |
| Sonrisas canónicas | CNCCC1=CC=CC=C1 |
| IUPAC Name | N-methyl-2-phenylethanamine |
| InChIKey | SASNBVQSOZSTPD-UHFFFAOYSA-N |
| INCHI | 1S/C9H13N/c1-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3 |
| Isómeros SMILES | CNCCC1=CC=CC=C1 |
| WGK Alemania | 3 |
| RTECS | SH9625000 |
| Peso molecular | 135.21 |
| Beilstein | 636347 |
| Reaxy-Rn | 636347 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636347&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 |
| Clase | Benzene and substituted derivatives |
| Subclass | Phenethylamines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenethylamines |
| Alternative Parents | Aralkylamines Dialkylamines Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenethylamine - Aralkylamine - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic homomonocyclic compound |
| Descripción | 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 |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | May 13, 2025 | N159074 | |
| Certificate of Analysis | May 13, 2025 | N159074 | |
| Certificate of Analysis | May 13, 2025 | N159074 | |
| Certificate of Analysis | May 13, 2025 | N159074 | |
| Certificate of Analysis | May 13, 2025 | N159074 | |
| Certificate of Analysis | Apr 03, 2025 | N159074 | |
| Certificate of Analysis | Apr 03, 2025 | N159074 | |
| Certificate of Analysis | May 06, 2021 | N159074 |
| Sensibilidad | air & heat sensitive |
|---|---|
| Índice de refracción | 1.5150 to 1.5190 |
| Punto de inflamación (°F) | 163.4 °F |
| Punto de inflamación (°C) | 73°C |
| Punto de ebullición (°C) | 203-205°C |
| Peso molecular | 135.210 g/mol |
| XLogP3 | 1.900 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 3 |
| Exact Mass | 135.105 Da |
| Monoisotopic Mass | 135.105 Da |
| Topological Polar Surface Area | 12.000 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 74.800 |
| 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. Xiaotu Liu, Xinyu Zhu, Shuyue Wang, Fengli Zhou, Ning Zhang, Ziliang Wang, Maohua Miao, Hong Liang, Meilin Yan, Xiangfei Sun, Da Chen. (2025) Chemically Labeled Exposome Analysis (CLEAN): A Strategy for Nontargeted Identification of Urinary Metabolites. ENVIRONMENTAL SCIENCE & TECHNOLOGY, [PMID:41116294] [10.1021/acs.est.5c07728] |