Cas no 15505-05-2 (Phosphonic acid,P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:6))

Phosphonic acid,P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:6) structure
15505-05-2 structure
Product Name:Phosphonic acid,P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:6)
CAS No:15505-05-2
MF:C3H6NNa6O9P3
MW:430.940948963165
CID:170073
PubChem ID:13710183
Update Time:2025-04-19

Phosphonic acid,P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:6) Chemical and Physical Properties

Names and Identifiers

    • Phosphonic acid,P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:6)
    • hexasodium [nitrilotris(methylene)]trisphosphonate
    • hexasodium,1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
    • hexasodium (nitrilotrimethanediyl)tris(phosphonate)
    • Hexasodium (nitrilotris(methylene))trisphosphonate
    • Phosphonic acid, (nitrilotris(methylene))tris-, hexasodium salt
    • DTXSID3029734
    • Hexasodium[nitrilotris(methylene)]trisphosphonate
    • hexasodium;1-phosphonato-N,N-bis(phosphonatomethyl)methanamine
    • hexasodium [nitrilotris(methylene)]tris(phosphonate)
    • Q27283082
    • UNII-LNG55J9F16
    • TRIS(PHOSPHONOMETHYL)AMINE HEXASODIUM SALT
    • NITRILOTRIS(METHYLENEPHOSPHONIC ACID) HEXASODIUM SALT
    • PHOSPHONIC ACID, (NITRILOTRIS(METHYLENE))TRI-, HEXASODIUM SALT
    • PHOSPHONIC ACID, P,P',P''-(NITRILOTRIS(METHYLENE))TRIS-, SODIUM SALT (1:6)
    • PHOSPHONIC ACID,(NITRILOTRIS(METHYLENE))TRIS-, HEXASODIUM SALT
    • LNG55J9F16
    • EINECS 239-534-6
    • Phosphonic acid, [nitrilotris(methylene)]tris-, hexasodium salt
    • 15505-05-2
    • NS00085055
    • Hexasodium aminotris(methylenephosphonate)
    • Inchi： 1S/C3H12NO9P3.6Na/c5-14(6,7)1-4(2-15(8,9)10)3-16(11,12)13;;;;;;/h1-3H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13);;;;;;/q;6*+1/p-6
    • InChI Key： NRNLPGTZUDJACV-UHFFFAOYSA-H
    • SMILES： P(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

Computed Properties

  • Exact Mass: 430.86438
  • Monoisotopic Mass: 430.864158
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 271
  • Covalently-Bonded Unit Count: 7
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 193

Experimental Properties

  • Density: g/cm3
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 192.81
  • LogP: 1.32320

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