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Details

Stereochemistry ACHIRAL
Molecular Formula C9H18N3O15P5.8Na.2H
Molecular Weight 749.0532
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTASODIUM DIETHYLENETRIAMINEPENTAMETHYLENEPHOSPHONATE

SMILES

[H+].[H+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[O-]P([O-])(=O)CN(CCN(CP([O-])([O-])=O)CP([O-])([O-])=O)CCN(CP([O-])([O-])=O)CP([O-])([O-])=O

InChI

InChIKey=WWXMCADBIVTUPI-UHFFFAOYSA-F
InChI=1S/C9H28N3O15P5.8Na/c13-28(14,15)5-10(1-3-11(6-29(16,17)18)7-30(19,20)21)2-4-12(8-31(22,23)24)9-32(25,26)27;;;;;;;;/h1-9H2,(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)(H2,25,26,27);;;;;;;;/q;8*+1/p-8

HIDE SMILES / InChI

Approval Year

Name Type Language
OCTASODIUM DIETHYLENETRIAMINEPENTAMETHYLENEPHOSPHONATE
Common Name English
DIETHYLENE TRIAMINE PENTA(METHYLENE PHOSPHONIC ACID), OCTASODIUM SALT
Preferred Name English
DIETHYLENETRIAMINEPENTAKIS(METHYLENEPHOSPHONIC ACID) OCTASODIUM SALT
Systematic Name English
PHOSPHONIC ACID, (((PHOSPHONOMETHYL)IMINO)BIS(2,1-ETHANEDIYLNITRILOBIS(METHYLENE)))TETRAKIS-, OCTASODIUM SALT
Common Name English
Code System Code Type Description
CAS
22042-96-2
Created by admin on Mon Mar 31 19:35:15 GMT 2025 , Edited by admin on Mon Mar 31 19:35:15 GMT 2025
NON-SPECIFIC STOICHIOMETRY
PUBCHEM
22833463
Created by admin on Mon Mar 31 19:35:15 GMT 2025 , Edited by admin on Mon Mar 31 19:35:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID5029843
Created by admin on Mon Mar 31 19:35:15 GMT 2025 , Edited by admin on Mon Mar 31 19:35:15 GMT 2025
PRIMARY
FDA UNII
18U8CZB0SP
Created by admin on Mon Mar 31 19:35:15 GMT 2025 , Edited by admin on Mon Mar 31 19:35:15 GMT 2025
PRIMARY
CAS
95183-54-3
Created by admin on Mon Mar 31 19:35:15 GMT 2025 , Edited by admin on Mon Mar 31 19:35:15 GMT 2025
PRIMARY