Name: iron sodium diphosphate
SKU: 10045-87-1

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Basic Information

Molecular Structure:
CAS No.:	10045-87-1
Name:	iron sodium diphosphate

Formula:	FeNaO₇P₂
Molecular Weight:	252.778092
Synonyms:	Sodium Ferric Pyrophosphate FCC V;Pyrophosphoricacid, iron(3+) sodium salt (1:1:1) (8CI);Sodium pyrophosphatoferrate(III)(NaFeP2O7) (7CI);Iron sodium diphosphate;Iron sodium diphosphate (FeNaP2O7);Iron sodium pyrophosphate (FeNaP2O7);Sodium ferric pyrophosphate;Sodium ironpyrophosphate;
EINECS:	233-150-2
PSA:	155.23000
LogP:	0.93870

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Specification

The Iron sodium pyrophosphate is an organic compound with the formula FeNaO₇P₂. The IUPAC name of this chemical is sodium; iron(3+); phosphonato phosphate. With the CAS registry number 10045-87-1, it is also named as Diphosphoric acid, iron(3+) sodium salt (1:1:1).

Physical properties about Iron sodium pyrophosphate are: (1)ACD/LogP: -3.42; (2)ACD/LogD (pH 5.5): -7.96; (3)ACD/LogD (pH 7.4): -8.64; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)#H bond acceptors: 7; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 143.91 Å².

You can still convert the following datas into molecular structure:
(1)SMILES: [Fe+3].[Na+].[O-]P([O-])(=O)OP([O-])([O-])=O
(2)InChI: InChI=1/Fe.Na.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q+3;+1;/p-4
(3)InChIKey: XWQGIDJIEPIQBD-XBHQNQODAM
(4)Std. InChI: InChI=1S/Fe.Na.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q+3;+1;/p-4
(5)Std. InChIKey: XWQGIDJIEPIQBD-UHFFFAOYSA-J