(4-phenoxyphenyl)methanamine - ≥98% , CAS No.107622-80-0

CAS: 107622-80-0 Cat. No.: P189593 Formula: C₁₃H₁₃NO Molecular Weight: 199.25 EC Number: 671-210-3 PubChem CID: 2760343

GRADE & PURITY ≥98%

Synonyms

FS-1206 | (4-phenoxyphenyl)methylamine | (4-phenoxyphenyl)methanamine;4-Phenoxybenzylamine | Benzenemethanamine, 4-phenoxy- | 1-(4-phenoxyphenyl)methanamine | BCP26391 | DTXSID60375120 | 4-phenoxybenzenemethanamine | 4-phenoxybenzylamine, AldrichCPR | STK

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

FS-1206 | (4-phenoxyphenyl)methylamine | (4-phenoxyphenyl)methanamine;4-Phenoxybenzylamine | Benzenemethanamine, 4-phenoxy- | 1-(4-phenoxyphenyl)methanamine | BCP26391 | DTXSID60375120 | 4-phenoxybenzenemethanamine | 4-phenoxybenzylamine, AldrichCPR | STK

Specifications & Purity

≥98%

Storage

Room temperature,Argon charged

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504761571
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761571
• Canonical Smiles: C1=CC=C(C=C1)OC2=CC=C(C=C2)CN
• IUPAC Name: (4-phenoxyphenyl)methanamine
• InChIKey: CCAZAGUSBMVSAR-UHFFFAOYSA-N
• INCHI: 1S/C13H13NO/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9H,10,14H2
• Isomeric SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)CN
• PubChem CID: 2760343
• Molecular Weight: 199.25

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Diphenylethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Diarylethers Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Aralkylamines Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylether - Diaryl ether - Benzylamine - Phenol ether - Phenylmethylamine - Phenoxy compound - Aralkylamine - Ether - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Air Sensitive
• Refractive Index: 1.59
• Flash Point(°C): 150 °C
• Molecular Weight: 199.250 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 199.1 Da
• Monoisotopic Mass: 199.1 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 169.000
• 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: 1

References

1. Suqin Wang, Hui Zhu, Ming Sheng, Bo Shao, Yu He, Zhuang Liu, Min Li, Guangtao Zhou.  (2025)  Achieving Ultralong Room-Temperature Phosphorescence in Two-Dimensional Metal-Halide Perovskites by Tuning Alkyl Chain Length.  Inorganics,  13  (4): (108).  [PMID:] [10.3390/inorganics13040108]