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Basic Description
| Synonyms | 1-Propanamine, 3-phenoxy- | CS-0046980 | SB75877 | AB01141761-03 | AKOS000123528 | MFCD04038049 | (3-Phenoxy)propylamine | phenoxypropylamine | FT-0724805 | SCHEMBL1320595 | BS-13393 | DXVQSHRBALIFBC-UHFFFAOYSA-N | 3-phenoxypropan-1-amine | AB01141761-04 |
|---|---|
| Specifications & Purity | ≥95% |
| Storage Temp | Room temperature |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
- Class Phenol ethers
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Phenol ethers |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenol ethers |
| Alternative Parents | Phenoxy compounds Alkyl aryl ethers Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring. |
| External Descriptors | Not available |
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Names and Identifiers
| Pubchem Sid | 488189704 |
|---|---|
| IUPAC Name | 3-phenoxypropan-1-amine |
| INCHI | InChI=1S/C9H13NO/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,10H2 |
| InChIKey | DXVQSHRBALIFBC-UHFFFAOYSA-N |
| Smiles | C1=CC=C(C=C1)OCCCN |
| Isomeric SMILES | C1=CC=C(C=C1)OCCCN |
| PubChem CID | 418237 |
| Molecular Weight | 151.2 |
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 |
|---|---|---|---|
 C2306158 |
Certificate of Analysis | Nov 09, 2022 | P353595 |
| C2525269 |
Certificate of Analysis | Nov 09, 2022 | P353595 |
| C2306157 |
Certificate of Analysis | Nov 09, 2022 | P353595 |
| C2306161 |
Certificate of Analysis | Nov 09, 2022 | P353595 |
Chemical and Physical Properties
| Boil Point(°C) | 241-242° C |
|---|---|
| Melt Point(°C) | 13-14° C |
| Molecular Weight | 151.210 g/mol |
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 151.1 Da |
| Monoisotopic Mass | 151.1 Da |
| Topological Polar Surface Area | 35.300 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 89.600 |
| 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 |
Solution Calculators
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