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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14N2O8.Fe.H4N
Molecular Weight 376.121
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMMONIUM FERRIC PROPANEDIAMINETETRAACETATE

SMILES

[NH4+].[Fe+3].[O-]C(=O)CN(CCCN(CC([O-])=O)CC([O-])=O)CC([O-])=O

InChI

InChIKey=HXPRIPOCSQBZIN-UHFFFAOYSA-K
InChI=1S/C11H18N2O8.Fe.H3N/c14-8(15)4-12(5-9(16)17)2-1-3-13(6-10(18)19)7-11(20)21;;/h1-7H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21);;1H3/q;+3;/p-3

HIDE SMILES / InChI

Molecular Formula C11H14N2O8
Molecular Weight 302.2375
Charge -4
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Fe
Molecular Weight 55.845
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H4N
Molecular Weight 18.0385
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 08:09:07 GMT 2023
Edited
by admin
on Sat Dec 16 08:09:07 GMT 2023
Record UNII
Y87L28QN8T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMMONIUM FERRIC PROPANEDIAMINETETRAACETATE
Common Name English
1,3-DIAMINOPROPANETETRAACETIC ACID IRON(III) AMMONIUM SALT
Systematic Name English
AMMONIUM 1,3-PROPYLENEDIAMINETETRAACETATOFERRATE
Common Name English
AMMONIUM (1,3-DIAMINOPROPANETETRAACETATO)IRON(III)
Systematic Name English
FERRATE(1-), ((N,N'-1,3-PROPANEDIYLBIS(N-((CARBOXY-.KAPPA.O)METHYL)GLYCINATO-.KAPPA.N,.KAPPA.O))(4-))-, AMMONIUM, (OC-6-21)-
Common Name English
Code System Code Type Description
FDA UNII
Y87L28QN8T
Created by admin on Sat Dec 16 08:09:07 GMT 2023 , Edited by admin on Sat Dec 16 08:09:07 GMT 2023
PRIMARY
PUBCHEM
159534
Created by admin on Sat Dec 16 08:09:07 GMT 2023 , Edited by admin on Sat Dec 16 08:09:07 GMT 2023
PRIMARY
CAS
111687-36-6
Created by admin on Sat Dec 16 08:09:07 GMT 2023 , Edited by admin on Sat Dec 16 08:09:07 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE