FERROUS SULFATE

General Information

Mainterm	FERROUS SULFATE
Doc Type	ASP
CAS Reg.No.(or other ID)	7782-63-0
Regnum	184.1315

From www.fda.gov

Computed Descriptors

2D Structure
CID	62662
IUPAC Name	iron(2+);sulfate;heptahydrate
InChI	InChI=1S/Fe.H2O4S.7H2O/c;1-5(2,3)4;;;;;;;/h;(H2,1,2,3,4);7*1H2/q+2;;;;;;;;/p-2
InChI Key	SURQXAFEQWPFPV-UHFFFAOYSA-L
Canonical SMILES	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Fe+2]
Molecular Formula	FeH14O11S

From Pubchem

Computed Properties

Property Name	Property Value
Molecular Weight	278.006
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	0
Complexity	62.2
CACTVS Substructure Key Fingerprint	A A A D c c A A P A B A A A A g A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A C A A A A A A A A A A A A A A A A A A A A A A A A D A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = =
Topological Polar Surface Area	95.6
Monoisotopic Mass	277.961
Exact Mass	277.961
Compound Is Canonicalized	True
Formal Charge	0
Heavy Atom Count	13
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Isotope Atom Count	0
Covalently-Bonded Unit Count	9

From Pubchem

Taxonomic Classification

Kingdom	Inorganic compounds
Superclass	Mixed metal/non-metal compounds
Class	Transition metal oxoanionic compounds
Subclass	Transition metal sulfates
Intermediate Tree Nodes	Not available
Direct Parent	Transition metal sulfates
Alternative Parents	Inorganic salts Inorganic oxides
Molecular Framework	Not available
Substituents	Transition metal sulfate - Inorganic oxide - Inorganic salt
Description	This compound belongs to the class of inorganic compounds known as transition metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is a transition metal.

From ClassyFire