Calcium lactate
Relevant Data
Food Additives Approved in the United States
Food Additives Approved by WHO:
General Information
Chemical name | Calcium lactate |
E No. | E 327 |
INS. | 327 |
CAS number | 814-80-2 |
Group | No |
Component of the group |
Group I, Additives (Group I) |
From webgate.ec.europa.eu
Authorisation of the use of this additive in Food Additives
The additive is authorised to be used in the following category(ies):
category(ies) | Individual restriction(s)/exception(s) | footnote |
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From webgate.ec.europa.eu
Computed Descriptors
Download SDF2D Structure | |
CID | 13144 |
IUPAC Name | calcium;2-hydroxypropanoate |
InChI | InChI=1S/2C3H6O3.Ca/c2*1-2(4)3(5)6;/h2*2,4H,1H3,(H,5,6);/q;;+2/p-2 |
InChI Key | MKJXYGKVIBWPFZ-UHFFFAOYSA-L |
Canonical SMILES | CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Ca+2] |
Molecular Formula | (C3H5O2)2Ca·nH2O (n = 0 - 5) |
Wikipedia | L-calcium lactate |
From Pubchem
Computed Properties
Property Name | Property Value |
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Molecular Weight | 218.218 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 0 |
Complexity | 53.5 |
CACTVS Substructure Key Fingerprint | A A A D c c B g O A 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 G g A A C A A A C B S g g A I C C A A A A g A I A A C Q C A I A A A A A A A A A A A F A A A A B E A A A A A A A A A A A A A A B 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 | 121.0 |
Monoisotopic Mass | 218.01 |
Exact Mass | 218.01 |
Compound Is Canonicalized | True |
Formal Charge | 0 |
Heavy Atom Count | 13 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Isotope Atom Count | 0 |
Covalently-Bonded Unit Count | 3 |
From Pubchem
Taxonomic Classification
Kingdom | Organic compounds |
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Superclass | Organic acids and derivatives |
Class | Carboxylic acids and derivatives |
Subclass | Carboxylic acid derivatives |
Intermediate Tree Nodes | Not available |
Direct Parent | Carboxylic acid salts |
Alternative Parents | |
Molecular Framework | Not available |
Substituents | Secondary alcohol - Carboxylic acid salt - Organic calcium salt - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound |
Description | This compound belongs to the class of organic compounds known as carboxylic acid salts. These are ionic derivatives of carboxylic acid. |
From ClassyFire