BOP Reagent(BOP) - ≥98% , CAS No.56602-33-6

CAS: 56602-33-6 Cat. No.: B106161 Fórmula: C₁₂H₂₂F₆N₆OP₂ Peso molecular: 442.29 Beilstein Registry Number: 4287025 Número CE: 260-279-1 PubChem CID: 151348

GRADE & PURITY ≥98%

Synonyms

(benzotriazol-1yloxy)-tris(dimethylamino)-phosphoniumhexafluorophosphate | (benzotriazol-1-yloxy)tris(dimethylamino) phosphonium hexafluorophosphate | benzotriazol-1-yloxytris(dimethylamino)phosphoniumhexafluorophosphate | benzotriazol-1-yl-oxy-tris(dimet

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

Usually used as reagent for Peptide coupling,Synthesis of esters,Esterification of carboxylic acids,Plasmid CAN-encapsulating liposomes,Synthesis of magnolamide for antioxidative activity,Catalyst for preparation of 9-acridinecaroboxamide derivative.

Specifications

Sinónimos

(benzotriazol-1yloxy)-tris(dimethylamino)-phosphoniumhexafluorophosphate | (benzotriazol-1-yloxy)tris(dimethylamino) phosphonium hexafluorophosphate | benzotriazol-1-yloxytris(dimethylamino)phosphoniumhexafluorophosphate | benzotriazol-1-yl-oxy-tris(dimet

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 508812644
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508812644
• Sorrisos canónicos: CN(C)[P+](N(C)C)(N(C)C)ON1C2=CC=CC=C2N=N1.F[P-](F)(F)(F)(F)F
• IUPAC Name: benzotriazol-1-yloxy-tris(dimethylamino)phosphanium;hexafluorophosphate
• InChIKey: MGEVGECQZUIPSV-UHFFFAOYSA-N
• INCHI: 1S/C12H22N6OP.F6P/c1-15(2)20(16(3)4,17(5)6)19-18-12-10-8-7-9-11(12)13-14-18;1-7(2,3,4,5)6/h7-10H,1-6H3;/q+1;-1
• SMILES isoméricas: CN(C)[P+](N(C)C)(N(C)C)ON1C2=CC=CC=C2N=N1.F[P-](F)(F)(F)(F)F
• WGK Alemanha: 3
• PubChem CID: 151348
• Número UN: 1325
• Peso molecular: 442.29
• Beilstein: 4287025
• Reaxy-Rn: 4287025

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzotriazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzotriazoles
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzotriazoles
• Alternative Parents: Benzenoids Triazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic salts Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzotriazole - Benzenoid - Heteroaromatic compound - 1,2,3-triazole - Triazole - Azole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as benzotriazoles. These are organic compounds containing a benzene fused to a triazole ring (a five-membered ring with two carbon atoms and three nitrogen atoms).
• 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

Propriedades químicas e físicas

• Solubilidade: Soluble in water (hydrolyses), acetone, and dichloromethane.
• Sensibilidade: Light & Moisture Sensitive.
• Ponto de fusão (°C): 135-140°C
• Peso molecular: 442.280 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 5
• Exact Mass: 442.123 Da
• Monoisotopic Mass: 442.123 Da
• Topological Polar Surface Area: 49.700 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 368.000
• 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