2-Phenylethylamine hydrochloride - 10mM in DMSO , CAS No.156-28-5

CAS: 156-28-5 Cat. No.: P421867 Molecular Weight: 157.64 EC Number: 205-849-2 PubChem CID: 9075

GRADE & PURITY 10mM in DMSO

Synonyms

2-Phenylethylamine Hydrochloride (Phenethylamine Hydrochloride; PEA HCl) 1.0 mg/ml in Methanol (as free base) | beta-Phenethylamine hydrochloride | CCG-214630 | Phenethylammonium chloride | 2-phenylethanamine;hydrochloride | PHENETHYLAMINE HCL | beta-Phen

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

2-Phenylethylamine hydrochloride is a biogenic aromatic amine.

Specifications

Synonyms

2-Phenylethylamine Hydrochloride (Phenethylamine Hydrochloride; PEA HCl) 1.0 mg/ml in Methanol (as free base) | beta-Phenethylamine hydrochloride | CCG-214630 | Phenethylammonium chloride | 2-phenylethanamine;hydrochloride | PHENETHYLAMINE HCL | beta-Phen

Specifications & Purity

10mM in DMSO

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: C1=CC=C(C=C1)CCN.Cl
• IUPAC Name: 2-phenylethanamine;hydrochloride
• InChIKey: SKHIBNDAFWIOPB-UHFFFAOYSA-N
• INCHI: 1S/C8H11N.ClH/c9-7-6-8-4-2-1-3-5-8;/h1-5H,6-7,9H2;1H
• Isomeric SMILES: C1=CC=C(C=C1)CCN.Cl
• WGK Germany: 3
• PubChem CID: 9075
• Molecular Weight: 157.64

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenethylamines
• Alternative Parents: 2-arylethylamines Aralkylamines Organopnictogen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenethylamine - 2-arylethylamine - Aralkylamine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Primary aliphatic amine - 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

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

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Melt Point(°C): 220-222°C
• Molecular Weight: 157.640 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 157.066 Da
• Monoisotopic Mass: 157.066 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 65.000
• 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

XLogP3

References

1. Shijin Xiong, Xiaoyan Xu, Qiaozhen Liu, Yazhou Xu, Hongbing Ren, Tao Xiong, Mingyong Xie.  (2023)  Integrated metatranscriptomics and metabolomics revealed the metabolic pathways of biogenic amines during Laotan Suancai fermentation.  Food Bioscience,      [PMID:] [10.1016/j.fbio.2023.103517]

2. Dan Zhou, Zhibo Tong, Hongmei Xie, Jiaotong Sun, Fenggui Chen.  (2023)  Effects of Additives on Electrochromic Properties of Nanocrystalline Tungsten Oxide Films Prepared by Complexation-Assisted Sol–Gel Method.  Materials,  16  (7): (2681).  [PMID:37048974] [10.3390/ma16072681]

3. Xirui Chen, Yujie Tu, Song Cheng, Xujing Guo, Tianying Lu, Yuqian Guo, Xiaolin Huang, Yonghua Xiong, Ben Zhong Tang.  (2022)  A colorimetric and ratiometric fluorescent paper chip for biogenic amine monitoring based on a simple pH-sensitive AIEgen.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.137928]

4. Xujing Guo, Xirui Chen, Rui Chen, Yujie Tu, Tianying Lu, Yuqian Guo, Liang Guo, Yonghua Xiong, Xiaolin Huang, Ben Zhong Tang.  (2022)  Ratiometric Monitoring of Biogenic Amines by a Simple Ammonia-Response Aiegen.  Foods,  11  (7): (932).  [PMID:35407018] [10.3390/foods11070932]

5. Han Huang, Yudi Liu, Yanjun Tong, Wei Zhao, Xiaomei Lyu, Ruijin Yang.  (2024)  High-Pressure Processing for Pickled Crabs: Safety, Quality and Flavor Assessment and Correlation Analysis of Spoilage Indicators.  Food Bioscience,      [PMID:] [10.1016/j.fbio.2024.105227]