Catalog Number
ACMA00021203
Product Name
MOF&Iron(III) 1,3,5-benzenetricarboxylate hydrate, porous (F-free MIL-100(Fe), KRICT F100) [Iron trimesate]
IUPAC Name
benzene-1,3,5-tricarboxylate;iron(3+);hydrate
Molecular Weight
280.98g/mol
InChI
InChI=1S/C9H6O6.Fe.H2O/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;/h1-3H,(H,10,11)(H,12,13)(H,14,15);;1H2/q;+3;/p-3
InChI Key
IYWIGQARCBIOTP-UHFFFAOYSA-K
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
3
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
280.938463g/mol
Hydrogen Bond Acceptor Count
7
Hydrogen Bond Donor Count
1
Monoisotopic Mass
280.938463g/mol
Topological Polar Surface Area
121Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0