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Basic Description
| Synonyms | 2982-54-9 | 4-benzyloxy-phenethylamine hcl | 2-(4-(benzyloxy)phenyl)ethanamine hydrochloride | Benzeneethanamine, 4-(phenylmethoxy)-, hydrochloride | 2-[4-(benzyloxy)phenyl]ethan-1-amine hydrochloride | 2-(4-benzyloxy-phenyl)-ethylamine hydrochloride | 2-(4-phenylmet |
|---|---|
| Specifications & Purity | ≥95% |
| Storage Temp | Argon charged |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
- Subclass Phenethylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Phenethylamines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenethylamines |
| Alternative Parents | Phenoxy compounds Phenol ethers 2-arylethylamines Aralkylamines Alkyl aryl ethers Organopnictogen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenethylamine - Phenoxy compound - 2-arylethylamine - Phenol ether - Alkyl aryl ether - Aralkylamine - Ether - Organic nitrogen compound - Hydrochloride - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen 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 |
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Names and Identifiers
| Pubchem Sid | 488188605 |
|---|---|
| IUPAC Name | 2-(4-phenylmethoxyphenyl)ethanamine;hydrochloride |
| INCHI | InChI=1S/C15H17NO.ClH/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14;/h1-9H,10-12,16H2;1H |
| InChIKey | GMEWDNMRTKWSEF-UHFFFAOYSA-N |
| Smiles | C1=CC=C(C=C1)COC2=CC=C(C=C2)CCN.Cl |
| Isomeric SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)CCN.Cl |
| Molecular Weight | 263.76 |
| Reaxy-Rn | 4031354 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4031354&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 B2307551 |
Certificate of Analysis | Dec 05, 2022 | B406496 |
| B2307408 |
Certificate of Analysis | Dec 05, 2022 | B406496 |
| B2307557 |
Certificate of Analysis | Dec 05, 2022 | B406496 |
| F2518033 |
Certificate of Analysis | Dec 05, 2022 | B406496 |
Chemical and Physical Properties
| Molecular Weight | 263.760 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 263.108 Da |
| Monoisotopic Mass | 263.108 Da |
| Topological Polar Surface Area | 35.300 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 193.000 |
| 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 |
Solution Calculators
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