Cas no 76123-46-1 (Acetic acid, calciummagnesium salt (9CI))
76123-46-1 structure
Product Name:Acetic acid, calciummagnesium salt (9CI)
CAS No:76123-46-1
MF:C8H12CaMgO8
MW:300.559082984924
CID:565649
PubChem ID:156383
Update Time:2025-04-19
Acetic acid, calciummagnesium salt (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, calciummagnesium salt (9CI)
- calcium magnesium(+2) cation tetraacetate
- calcium,magnesium,tetraacetate
- Acetic acid,calcium magnesium salt
- Calcium magnesium acetate
- Chevron ice-B-gon deicer
- CMA 100
- ZORPJCONVDWMSP-UHFFFAOYSA-J
- 76123-46-1
- calcium;magnesium;tetraacetate
- DTXSID20226987
-
- Inchi： 1S/4C2H4O2.Ca.Mg/c4*1-2(3)4;;/h4*1H3,(H,3,4);;/q;;;;2*+2/p-4
- InChI Key： ZORPJCONVDWMSP-UHFFFAOYSA-J
- SMILES： [Ca+2].[Mg+2].[O-]C(C)=O.[O-]C(C)=O.[O-]C(C)=O.[O-]C(C)=O
Computed Properties
- Exact Mass: 300.00100
- Monoisotopic Mass: 300.001
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 25.5
- Covalently-Bonded Unit Count: 6
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 161A^2
Experimental Properties
- Boiling Point: 117.1°C at 760 mmHg
- Flash Point: 40°C
- PSA: 160.52000
- LogP: -4.97520
Acetic acid, calciummagnesium salt (9CI) Security Information
- Toxicity：LD50 orally in male, female rats: 3240, 3071 mg/kg (Rausina)
Acetic acid, calciummagnesium salt (9CI) Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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