Determine the necessary mass, volume, or concentration for preparing a solution.
≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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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.
| Canonical Smiles | CC(CC1=CC=C(C=C1)OC)NCC2=CC=CC=C2 |
|---|---|
| IUPAC Name | N-benzyl-1-(4-methoxyphenyl)propan-2-amine |
| InChIKey | CVGPWMGXKOKNFD-UHFFFAOYSA-N |
| INCHI | 1S/C17H21NO/c1-14(18-13-16-6-4-3-5-7-16)12-15-8-10-17(19-2)11-9-15/h3-11,14,18H,12-13H2,1-2H3 |
| Isomeric SMILES | CC(CC1=CC=C(C=C1)OC)NCC2=CC=CC=C2 |
| Molecular Weight | 255.36 |
| Reaxy-Rn | 3340558 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3340558&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Phenethylamines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Amphetamines and derivatives |
| Alternative Parents | Phenylpropanes Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Aralkylamines Alkyl aryl ethers Dialkylamines Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Amphetamine or derivatives - Phenylpropane - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Ether - Secondary aliphatic amine - Secondary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-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 |
|---|---|---|---|
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 | |
| Certificate of Analysis | Mar 18, 2024 | N193401 |
| Sensitivity | Light sensitive |
|---|---|
| Molecular Weight | 255.350 g/mol |
| XLogP3 | 3.700 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 255.162 Da |
| Monoisotopic Mass | 255.162 Da |
| Topological Polar Surface Area | 21.300 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 229.000 |
| 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 |