Tris(1-aziridinyl)phosphine oxide - ≥95% , CAS No.545-55-1

CAS: 545-55-1 Cat. No.: T1069331 Fórmula: C₆H₁₂N₃OP Peso molecular: 173.15 PubChem CID: 11016

GRAU & PUREZA ≥95%

Storage

Room temperature

Shipped In

FedEx DG Service

Especificações

Especificações e pureza

≥95%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

FedEx DG Service

Pureza

≥95%

Nomes e identificadores

Sorrisos canónicos

C1CN1P(=O)(N2CC2)N3CC3

IUPAC Name

1-[bis(aziridin-1-yl)phosphoryl]aziridine

InChIKey

FYAMXEPQQLNQDM-UHFFFAOYSA-N

INCHI

1S/C6H12N3OP/c10-11(7-1-2-7,8-3-4-8)9-5-6-9/h1-6H2

SMILES isoméricas

C1CN1P(=O)(N2CC2)N3CC3

PubChem CID

11016

Número UN

2501(solution)

Grupo de embalagem

II

Peso molecular

173.15

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic phosphoric acids and derivatives
      • Subclass Organic phosphoramides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic phosphoric acids and derivatives
• Subclass: Organic phosphoramides
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic phosphoramides
• Alternative Parents: Aziridines Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Organic phosphoric acid amide - Azacycle - Organoheterocyclic compound - Aziridine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organic phosphoramides. These are organic compounds containing the phosphoric acid amide functional group.
• External Descriptors: phosphoramide

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

• Ponto de ebulição (°C): 292-306° C at 760 mmHg (Predicted)
• Ponto de fusão (°C): 36-41° C
• Peso molecular: 173.150 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 173.072 Da
• Monoisotopic Mass: 173.072 Da
• Topological Polar Surface Area: 26.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 194.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 545-55-1, the molecular formula is C6H12N3OP, and the molecular weight is 173.15 g/mol. InChIKey FYAMXEPQQLNQDM-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.