Ammonium polyphosphate（APP） - n≥1500 , CAS No.68333-79-9

CAS: 68333-79-9 Cat. No.: A669915 分子式: (NH₄PO₃)n EC番号: 269-789-9

グレード＆純度 n≥1500

Storage

Room temperature

Shipped In

Normal

仕様

仕様と純度

n≥1500

保管条件

Room temperature

入荷

Normal

Product Line

A669915-25g

名前と識別子

パブケム・シド

528774855

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/528774855

カノニカル・スマイル

[NH4+].[NH4+].[NH4+].[O-]P(=O)([O-])[O-]

IUPAC Name

triazanium;phosphate

InChIKey

ZRIUUUJAJJNDSS-UHFFFAOYSA-N

INCHI

1S/3H3N.H3O4P/c;;;1-5(2,3)4/h3*1H3;(H3,1,2,3,4)

異性体SMILES

[NH4+].[NH4+].[NH4+].[O-]P(=O)([O-])[O-]

Reaxy-Rn

13206739

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13206739&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Inorganic compounds
  • Superclass Homogeneous non-metal compounds
    • 分類 Non-metal oxoanionic compounds
      • Subclass Non-metal phosphates

• Kingdom: Inorganic compounds
• Superclass: Homogeneous non-metal compounds
• 分類: Non-metal oxoanionic compounds
• Subclass: Non-metal phosphates
• Intermediate Tree Nodes: Not available
• Direct Parent: Non-metal phosphates
• Alternative Parents: Inorganic salts Inorganic oxides
• Molecular Framework: Not available
• Substituents: Non-metal phosphate - Inorganic oxide - Inorganic salt
• 説明: This compound belongs to the class of inorganic compounds known as non-metal phosphates. These are inorganic non-metallic compounds containing a phosphate as its largest oxoanion.
• 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

化学的性質と物理的性質

• 分子量: 149.090 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 149.057 Da
• Monoisotopic Mass: 149.057 Da
• Topological Polar Surface Area: 89.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 36.800
• 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: 4

XLogP3