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Gadolinium(III) chloride hydrate - 99.99% trace metals basis, high purity , CAS No.19423-81-5
Basic Description
Synonyms
gadolinium(3+);trichloride;hydrate | Gadolinium chloride, hydrate | DTXSID20941148 | Gadolinium chloride--water (1/3/1) | Gadolinium chloride(GdCl3), hydrate (8CI,9CI) | Gadolinium chloride (GdCl3), hydrate
Specifications & Purity
PrimorTrace™, ≥99.99% metals basis
Grade
PrimorTrace™
Product Description
Description
Employed in synthesis and NMR studies of the paramagnetic GdPCTA-[12] and GdPCTA-[13] complexes with possible use as contrast agents for magnetic resonance imaging.
Taxonomic Classification
Kingdom
Inorganic compounds
Superclass
Mixed metal/non-metal compounds
Class
Lanthanide salts
Subclass
Lanthanide chlorides
Intermediate Tree Nodes
Not available
Direct Parent
Lanthanide chlorides
Alternative Parents
Inorganic chloride salts
Molecular Framework
Not available
Substituents
Lanthanide chloride - Inorganic chloride salt - Inorganic salt
Description
This compound belongs to the class of inorganic compounds known as lanthanide chlorides. These are inorganic compounds in which the largest halogen atom is Chlorine, and the heaviest metal atom is a lanthanide.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
504757735
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504757735
IUPAC Name
gadolinium(3+);trichloride;hydrate
INCHI
InChI=1S/3ClH.Gd.H2O/h3*1H;;1H2/q;;;+3;/p-3
InChIKey
SXVCBXHAHBCOMV-UHFFFAOYSA-K
Smiles
O.[Cl-].[Cl-].[Cl-].[Gd+3]
Isomeric SMILES
O.[Cl-].[Cl-].[Cl-].[Gd+3]
Molecular Weight
263.61 (anhydrous basis)
Reaxy-Rn
31147793
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=31147793&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
281.620 g/mol
XLogP3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
0
Exact Mass
280.841 Da
Monoisotopic Mass
280.841 Da
Topological Polar Surface Area
1.000 Ų
Heavy Atom Count
5
Formal Charge
0
Complexity
0.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
5
Citations of This Product
1.
Chen Sihan, Hu Huiqi, Jiang Wenting, Zhang Yuyun, Luo Xiaohu, Peng Jiayi, Li Le, Zhen Deshuai, Wang Hanqing.
(2023)
DNAzyme modified NaYF4: Yb, Tm, Gd for near-infrared fluorescence detection of uranyl. Materials Express,
13
(11):
(1915-1921).
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1 Citations
K2330226