(4-(1,2,4,5-Tetrazin-3-yl)phenyl)methanamine hydrochloride - ≥95% , CAS No.1416711-59-5

CAS: 1416711-59-5 Cat. No.: T587187 Peso molecular: 223.66 Número EC: 856-804-4 PubChem CID: 86767671

GRADE & PURITY ≥95%

Synonyms

(4-(1,2,4,5-tetrazin-3-yl)phenyl)methanamine hydrochloride | 1-[4-(1,2,4,5-TETRAZIN-3-YL)PHENYL]METHANAMINE HYDROCHLORIDE | SY122744 | [4-(1,2,4,5-tetrazin-3-yl)phenyl]methanamine;hydrochloride | (4-?(1,?2,?4,?5-?tetrazin-?3-?yl)?phenyl)?methanamine HCL |

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

(4-(1, 2, 4, 5-tetrazin-3-yl)phenyl)methanamine hydrochloride | 1-[4-(1, 2, 4, 5-TETRAZIN-3-YL)PHENYL]METHANAMINE HYDROCHLORIDE | SY122744 | [4-(1, 2, 4, 5-tetrazin-3-yl)phenyl]methanamine;hydrochloride | (4-?(1, ?2, ?4, ?5-?tetrazin-?3-?yl)?phenyl)?methanamine HCL |

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504772510
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504772510
• Sonrisas canónicas: C1=CC(=CC=C1CN)C2=NN=CN=N2.Cl
• IUPAC Name: [4-(1,2,4,5-tetrazin-3-yl)phenyl]methanamine;hydrochloride
• InChIKey: FAAUXGMWUKVOPI-UHFFFAOYSA-N
• INCHI: 1S/C9H9N5.ClH/c10-5-7-1-3-8(4-2-7)9-13-11-6-12-14-9;/h1-4,6H,5,10H2;1H
• Isómeros SMILES: C1=CC(=CC=C1CN)C2=NN=CN=N2.Cl
• PubChem CID: 86767671
• Peso molecular: 223.66

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Aralkylamines Tetrazines Heteroaromatic compounds Azacyclic compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylmethylamine - Benzylamine - Aralkylamine - Tetrazine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• 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

Propiedades químicas y físicas

• Sensibilidad: moisture&light sensitive
• Peso molecular: 223.660 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 223.062 Da
• Monoisotopic Mass: 223.062 Da
• Topological Polar Surface Area: 77.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 161.000
• 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

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