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Dicalcium pyrophosphate

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Name

Dicalcium pyrophosphate

EINECS 232-221-5
CAS No. 7790-76-3 Density 3.09 g/cm3
PSA 155.23000 LogP 0.94120
Solubility insoluble in water, soluble in dilute hydrochloric acid and nitric acid, insoluble in alcohol Melting Point 1230 °C
Formula Ca.1/2H4O7P2 Boiling Point N/A
Molecular Weight 256.10 Flash Point N/A
Transport Information N/A Appearance white powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 7790-76-3 (CALCIUM PYROPHOSPHATE) Hazard Symbols IrritantXi
Synonyms

Calciumpyrophosphate (Ca2P2O7) (6CI);Pyrophosphoric acid, calcium salt (1:2) (8CI);C54-80;Calcium diphosphate (Ca2P2O7);Calcium phosphate (Ca2P2O7);Dicalcium diphosphate;Dicalcium pyrophosphate;NP 970-10;Calcium pyrophosphate;

 

Dicalcium pyrophosphate Specification

The Calcium pyrophosphate with CAS registry number of 7790-76-3 is also known as Dicalcium diphosphate. The IUPAC name is Dicalcium phosphonato phosphate. It belongs to product categories of Inorganics. Its EINECS registry number is 232-221-5. In addition, the formula is Ca.1/2H4O7P2 and the molecular weight is 256.10.

Physical properties about Calcium pyrophosphate are: (1)ACD/LogP: -3.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -7.96; (4)ACD/LogD (pH 7.4): -8.64; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1 ; (7)#H bond acceptors: 7; (8)#H bond donors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 143.91Å2.

Preparation of Calcium pyrophosphate: it is prepared by reaction of anhydrous sodium pyrophosphate with danhydrous calcium chloride. Add anhydrous sodium pyrophosphate slowly to anhydrous calcium chloride under stirring, then heated to 90 °C. Remove the supernatant, and wash the lower liquid. Drying, calcining
, crushing to obtain the product.

Calcium pyrophosphate is prepared by reaction of anhydrous sodium pyrophosphate with danhydrous calcium chloride.

Uses of Calcium pyrophosphate: it can be used as nutritional supplement, yeast nutrients, buffer, neutralizer. What's more, this chemical can also be used as toothpaste abrasive, paint filler, electrical equipment and fluorescent.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. SMILES: [Ca+2].[Ca+2].[O-]P([O-])(=O)OP([O-])([O-])=O
2. InChI: InChI=1/2Ca.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q2*+2;/p-4
3. InChIKey: JUNWLZAGQLJVLR-XBHQNQODAN
4. Std. InChI: InChI=1S/2Ca.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q2*+2;/p-4
5. Std. InChIKey: JUNWLZAGQLJVLR-UHFFFAOYSA-J

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3300mg/kg (3300mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 30(10), Pg. 28, 1965.
mouse LDLo intraperitoneal 100mg/kg (100mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 30(10), Pg. 28, 1965.

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