Cas no 10049-18-0 (Diphosphoric acid,iron(3+) salt (3:4), nonahydrate (9CI))
10049-18-0 structure
Product Name:Diphosphoric acid,iron(3+) salt (3:4), nonahydrate (9CI)
CAS No:10049-18-0
MF:Fe4H18O30P6
MW:907.347493648529
CID:118327
PubChem ID:72710688
Update Time:2025-04-18
Diphosphoric acid,iron(3+) salt (3:4), nonahydrate (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Diphosphoric acid,iron(3+) salt (3:4), nonahydrate (9CI)
- Ironpyrophosphate Fe4(P2O7)3, nonahydrate
- iron(3+),phosphonato phosphate,nonahydrate
- Iron(III)pyrophosphate nonahydarate
- 1ZJR117WBQ
- Ferric pyrophosphate nonahydrate
- 10049-18-0
- DTXSID80905549
- Plerixafor octahydrochloride [MI]
- UNII-1ZJR117WBQ
- Q27253339
- Iron(3+) diphosphate--water (4/3/9)
-
- Inchi： 1S/4Fe.3H4O7P2.9H2O/c;;;;3*1-8(2,3)7-9(4,5)6;;;;;;;;;/h;;;;3*(H2,1,2,3)(H2,4,5,6);9*1H2/q4*+3;;;;;;;;;;;;/p-12
- InChI Key： VYRMLVOEDYFANG-UHFFFAOYSA-B
- SMILES： [Fe+3].[Fe+3].[Fe+3].[Fe+3].P(=O)([O-])([O-])OP(=O)([O-])[O-].P(=O)([O-])([O-])OP(=O)([O-])[O-].P(=O)([O-])([O-])OP(=O)([O-])[O-].O.O.O.O.O.O.O.O.O
Computed Properties
- Exact Mass: 907.5706g/mol
- Monoisotopic Mass: 907.5706g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 9
- Hydrogen Bond Acceptor Count: 30
- Heavy Atom Count: 40
- Rotatable Bond Count: 0
- Complexity: 124
- Covalently-Bonded Unit Count: 16
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 907.3g/mol
- Topological Polar Surface Area: 416?2
Experimental Properties
- PSA: 548.76000
- LogP: 2.23490
Diphosphoric acid,iron(3+) salt (3:4), nonahydrate (9CI) Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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