1,3,5-Triazine - ≥98%(GC) , CAS No.290-87-9

CAS: 290-87-9 Cat. No.: T162480 Formula: C₃H₃N₃ Peso molecolare: 81.08 Beilstein Registry Number: 104790 Numero EC: 206-028-1 PubChem CID: 9262

GRADE & PURITY ≥98%(GC)

Synonyms

NSC 56189 | S-TRIAZINE [MI] | SB73673 | s-Triazine-(1,3,5) | SY031707 | UNII-8B5F4CM81E | EINECS 206-028-1 | EN300-73629 | Vedita 250 | CHEBI:30259 | InChI=1/C3H3N3/c1-4-2-6-3-5-1/h1-3 | s-Triazine, 97% | MFCD00006044 | s-Triazine | DTXSID7052785 | 1,3,5-

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Panoramica

1,3,5-Triazine is a useful replacement for HCN in the Gattermann reaction for the synthesis of aromatic aldehydes. It reacts with nucleophiles, e.g. amines, which is utilized in quinazoline synthesis.

Specifications

Sinonimi

NSC 56189 | S-TRIAZINE [MI] | SB73673 | s-Triazine-(1,3,5) | SY031707 | UNII-8B5F4CM81E | EINECS 206-028-1 | EN300-73629 | Vedita 250 | CHEBI:30259 | InChI=1/C3H3N3/c1-4-2-6-3-5-1/h1-3 | s-Triazine, 97% | MFCD00006044 | s-Triazine | DTXSID7052785 | 1,3,5-

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Store at -20°C,Argon charged

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%(GC)

Nomi e identificatori

Pubchem Sid

504751811

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751811

Sorrisi canonici

C1=NC=NC=N1

IUPAC Name

1,3,5-triazine

InChIKey

JIHQDMXYYFUGFV-UHFFFAOYSA-N

INCHI

1S/C3H3N3/c1-4-2-6-3-5-1/h1-3H

Isomeri SMILES

C1=NC=NC=N1

WGK Germania

3

RTECS

XY2957000

PubChem CID

9262

Peso molecolare

81.08

Beilstein

104790

Reaxy-Rn

104790

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Triazines
      • Subclass 1,3,5-triazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Triazines
• Subclass: 1,3,5-triazines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,3,5-triazines
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 1,3,5-triazine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as 1,3,5-triazines. These are compounds containing a triazine ring, which is a heterocyclic ring, similar to the six-member benzene ring but with three carbons replaced by nitrogen atoms, at ring positions 1, 3, and 5.
• External Descriptors: 1,3,5-triazines - triazine

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in ethanol (50 mg/ml), and methanol (100 mg/ml).
• Sensibilità: Moisture sensitive.
• Punto di ebollizione (°C): 114 °C
• Punto di fusione (°C): 79-83°C
• Peso molecolare: 81.080 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 81.0327 Da
• Monoisotopic Mass: 81.0327 Da
• Topological Polar Surface Area: 38.700 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 21.500
• 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