Cas no 6150-79-4 ( )
structure
Product Name:
CAS No:6150-79-4
MF:C12H38Mg3O28
MW:703.328329563141
CID:954609
PubChem ID:72710690
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- TRI-MAGNESIUM DICITRATE-14-HYDRATE
- X88335YT7M
- Magnesium citrate hydrate (3:2:14)
- 6150-79-4
- DTXSID10410439
- magnesium citrate tetradecahydrate
- Magnesium2-hydroxypropane-1,2,3-tricarboxylatetetradecahydrate
- Magnesium citrate tetradecanehydrate
- Magnesium citrate tribasic tetradecanehydrate [MI]
- Q27293681
- Magnesium 2-hydroxypropane-1,2,3-tricarboxylate tetradecahydrate
- 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, magnesium salt, hydrate (2:3:14)
- Trimagnesium dicitrate tetradecanehydrate
- UNII-X88335YT7M
-
-
- Inchi： 1S/2C6H8O7.3Mg.14H2O/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);;;;14*1H2/q;;3*+2;;;;;;;;;;;;;;/p-6
- InChI Key： YDQURDHFAGFVOV-UHFFFAOYSA-H
- SMILES： [Mg+2].[Mg+2].[Mg+2].OC(C(=O)[O-])(CC(=O)[O-])CC(=O)[O-].OC(C(=O)[O-])(CC(=O)[O-])CC(=O)[O-].O.O.O.O.O.O.O.O.O.O.O.O.O.O
Computed Properties
- Exact Mass: 324.11621
- Monoisotopic Mass: 702.1100856g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 16
- Hydrogen Bond Acceptor Count: 28
- Heavy Atom Count: 43
- Rotatable Bond Count: 4
- Complexity: 211
- Covalently-Bonded Unit Count: 19
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 295?2
Experimental Properties
- PSA: 35.53
Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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