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CAS No.: | 4195-60-2 |
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Name: | Calcium dipotassium dicarbonate |
Molecular Structure: | |
Formula: | C2CaK2O6 |
Molecular Weight: | 238.2924 |
Synonyms: | Calciumpotassium carbonate (7CI);Calcium potassium carbonate (CaK2(CO3)2);Calciumpotassium carbonate (K2Ca(CO3)2); |
EINECS: | 224-077-7 |
Boiling Point: | 333.6 °C at 760 mmHg |
Flash Point: | 169.8 °C |
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The Calcium dipotassium dicarbonate, with the CAS registry number of 4195-60-2, is also known as Carbonic acid, calcium potassium salt (2:1:2). Its EINECS registry number is 224-077-7. This chemical's molecular formula is C2CaK2O6 and molecular weight is 238.2924. What's more, its systematic name is called Calcium potassium carbonate (1:2:2).
Physical properties about Calcium dipotassium dicarbonate are: (1)ACD/LogP: -0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.98; (4)ACD/LogD (pH 7.4): -3.77; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 57.53 Å2; (13)Flash Point: 169.8 °C; (14)Enthalpy of Vaporization: 63.37 kJ/mol; (15)Boiling Point: 333.6 °C at 760 mmHg; (16)Vapour Pressure: 2.58E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: [K+].[Ca+2].[K+].[O-]C([O-])=O.[O-]C([O-])=O
(2) InChI: InChI=1/2CH2O3.Ca.2K/c2*2-1(3)4;;;/h2*(H2,2,3,4);;;/q;;+2;2*+1/p-4
(3) InChIKey: FTMOEEJQSGJJMS-XBHQNQODAJ