Calcium citrate tetrahydrate - CAS 5785-44-4
Catalog: |
BB029847 |
Product Name: |
Calcium citrate tetrahydrate |
CAS: |
5785-44-4 |
Synonyms: |
tricalcium;2-hydroxypropane-1,2,3-tricarboxylate;tetrahydrate |
IUPAC Name: | tricalcium;2-hydroxypropane-1,2,3-tricarboxylate;tetrahydrate |
Description: | Calcium citrate tetrahydrate (CAS# 5785-44-4) is used as the carbon source in the preparation of porous carbon without an activation process. |
Molecular Weight: | 570.49 |
Molecular Formula: | C12H18Ca3O18 |
Canonical SMILES: | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.O.O.[Ca+2].[Ca+2].[Ca+2] |
InChI: | InChI=1S/2C6H8O7.3Ca.4H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;4*1H2/q;;3*+2;;;;/p-6 |
InChI Key: | LNIZKKFWMDARJV-UHFFFAOYSA-H |
Boiling Point: | 309.6 °C at 760 mmHg |
Purity: | 95 % |
Appearance: | White fine powder |
LogP: | -3.21680 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22855333 | 20121001 | The effect of vitamin D on calcium absorption in older women | The Journal of clinical endocrinology and metabolism |
22449524 | 20120401 | Effect of calcium citrate on bone integration in a rabbit femur defect model | Asian Pacific journal of tropical medicine |
21854451 | 20120301 | Calcium supplements lower bone resorption after renal transplant | Clinical transplantation |
22437685 | 20120201 | Anticaries effect of dentifrices with calcium citrate and sodium trimetaphosphate | Journal of applied oral science : revista FOB |
21703942 | 20120101 | Biochemical control of bone loss and stone-forming propensity by potassium-calcium citrate after bariatric surgery | Surgery for obesity and related diseases : official journal of the American Society for Bariatric Surgery |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 9 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 569.9370863 |
Formal Charge: | 0 |
Heavy Atom Count: | 33 |
Hydrogen Bond Acceptor Count: | 18 |
Hydrogen Bond Donor Count: | 6 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 569.9370863 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 285 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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