CALCIUM SILICATE

Relevant Data

Food Additives Approved by WHO:

CALCIUM SILICATE [show]

Food Additives Approved by European Union:

Calcium silicate [show]

General Information

Mainterm	CALCIUM SILICATE
Doc Type	ASP
CAS Reg.No.(or other ID)	1344-95-2
Regnum	175.300 176.170 177.2260 178.3297 177.1680 177.2355 169.179 172.410 182.2227 182.2906 573.260

From www.fda.gov

Computed Descriptors

2D Structure
CID	14941
IUPAC Name	dicalcium;silicate
InChI	InChI=1S/2Ca.O4Si/c;;1-5(2,3)4/q2*+2;-4
InChI Key	JHLNERQLKQQLRZ-UHFFFAOYSA-N
Canonical SMILES	[O-][Si]([O-])([O-])[O-].[Ca+2].[Ca+2]
Molecular Formula	Ca2O4Si
Wikipedia	Calcium silicate

From Pubchem

Computed Properties

Property Name	Property Value
Molecular Weight	172.237
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Complexity	19.1
CACTVS Substructure Key Fingerprint	A A A D c Q A A O A g 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 A A E 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 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	92.2
Monoisotopic Mass	171.882
Exact Mass	171.882
Compound Is Canonicalized	True
Formal Charge	0
Heavy Atom Count	7
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	3

From Pubchem

Taxonomic Classification

Kingdom	Inorganic compounds
Superclass	Mixed metal/non-metal compounds
Class	Alkaline earth metal oxoanionic compounds
Subclass	Alkaline earth metal silicates
Intermediate Tree Nodes	Not available
Direct Parent	Alkaline earth metal silicates
Alternative Parents	Miscellaneous silicates Metalloid salts Inorganic oxides Inorganic calcium salts
Molecular Framework	Not available
Substituents	Silicate - Alkaline earth metal silicate - Inorganic calcium salt - Inorganic oxide - Inorganic salt - Inorganic metalloid salt
Description	This compound belongs to the class of inorganic compounds known as alkaline earth metal silicates. These are inorganic compounds in which the largest oxoanion is silicate, and in which the heaviest atom not in an oxoanion is an alkaline earth metal.

From ClassyFire