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Details

Stereochemistry ACHIRAL
Molecular Formula C10H20N2O12P4.8K
Molecular Weight 796.9534
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTAPOTASSIUM (HEXANE-1,6- DIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONATE

SMILES

[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[O-]P([O-])(=O)CN(CCCCCCN(CP([O-])([O-])=O)CP([O-])([O-])=O)CP([O-])([O-])=O

InChI

InChIKey=LUPDLFAHXJFLOR-UHFFFAOYSA-F
InChI=1S/C10H28N2O12P4.8K/c13-25(14,15)7-11(8-26(16,17)18)5-3-1-2-4-6-12(9-27(19,20)21)10-28(22,23)24;;;;;;;;/h1-10H2,(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;;;/q;8*+1/p-8

HIDE SMILES / InChI

Molecular Formula C10H20N2O12P4
Molecular Weight 484.167
Charge -8
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:07:17 GMT 2023
Edited
by admin
on Sat Dec 16 08:07:17 GMT 2023
Record UNII
2Y54ED495I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OCTAPOTASSIUM (HEXANE-1,6- DIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONATE
Common Name English
PHOSPHINIC ACID, (1,6-HEXANEDIYLBIS(NITRILOBIS(METHYLENE)))TETRAKIS-, OCTAPOTASSIUM SALT
Systematic Name English
Code System Code Type Description
CAS
63069-27-2
Created by admin on Sat Dec 16 08:07:17 GMT 2023 , Edited by admin on Sat Dec 16 08:07:17 GMT 2023
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PUBCHEM
22979262
Created by admin on Sat Dec 16 08:07:17 GMT 2023 , Edited by admin on Sat Dec 16 08:07:17 GMT 2023
PRIMARY
FDA UNII
2Y54ED495I
Created by admin on Sat Dec 16 08:07:17 GMT 2023 , Edited by admin on Sat Dec 16 08:07:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID50212393
Created by admin on Sat Dec 16 08:07:17 GMT 2023 , Edited by admin on Sat Dec 16 08:07:17 GMT 2023
PRIMARY
ECHA (EC/EINECS)
263-838-8
Created by admin on Sat Dec 16 08:07:17 GMT 2023 , Edited by admin on Sat Dec 16 08:07:17 GMT 2023
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