Triammonium phosphate trihydrate - AR, ≥98% , CAS No.25447-33-0

CAS: 25447-33-0 Cat. No.: A112552 Molecular Weight: 203.13 EC Number: 836-876-3

GRADE & PURITY AR, ≥98%

Synonyms

Triammonium phosphate trihydrate | Ammonium phosphate--water (3/1/3) | DTXSID70631284 | Phosphoric acid, triammonium salt, trihydrate | AKOS028109600 | triazanium;phosphate;trihydrate

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Triammonium phosphate trihydrate | Ammonium phosphate--water (3/1/3) | DTXSID70631284 | Phosphoric acid, triammonium salt, trihydrate | AKOS028109600 | triazanium;phosphate;trihydrate

Specifications & Purity

AR, ≥98%

Storage

Room temperature

Shipped In

Normal

Grade

AR

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504769388
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769388
• Canonical Smiles: [NH4+].[NH4+].[NH4+].O.O.O.[O-]P(=O)([O-])[O-]
• IUPAC Name: triazanium;phosphate;trihydrate
• InChIKey: DDXPLCBTGWFAIG-UHFFFAOYSA-N
• INCHI: 1S/3H3N.H3O4P.3H2O/c;;;1-5(2,3)4;;;/h3*1H3;(H3,1,2,3,4);3*1H2
• Isomeric SMILES: [NH4+].[NH4+].[NH4+].O.O.O.[O-]P(=O)([O-])[O-]
• Molecular Weight: 203.13
• Reaxy-Rn: 15934825
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15934825&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Inorganic compounds
• Superclass: Homogeneous non-metal compounds
• Class: 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
• Description: 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

Chemical and Physical Properties

• Molecular Weight: 203.130 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 0
• Exact Mass: 203.088 Da
• Monoisotopic Mass: 203.088 Da
• Topological Polar Surface Area: 92.300 Ų
• Heavy Atom Count: 11
• 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: 7

XLogP3

References

1. Fengliang Cao, Wanxin Ni, Qingshan Zhao, Libo Wang, Song Xue, Yanpeng Li, Debin Kong, Mingbo Wu, Linjie Zhi.  (2024)  Precisely manipulating the local coordination of cobalt single-atom catalyst boosts selective hydrogenation of nitroarenes.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2024.123762]