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Europium-thd

CAT: 0862-GX1796-1gSize: 1 gDry Ice: NoHazardous: No
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CAT#:0862-GX1796-1gSize:1 g
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CAS Number
15522-71-1
HS Code
2846907010
Molecular Formula
(C11H19O2) 3Eu
Molecular Weight
701.77
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Tris(2,2,6,6-tetramethylheptane-3,5-dionato-O,O')europium
CAS Number15522-71-1
PubChem CID5486784
IUPAC Nameeuropium(3+);tris((Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)
Molecular FormulaC33H57EuO6
Molecular Weight701.8
Topological Polar Surface Area120
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count40
Formal Charge0
Complexity199
SMILES
CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Eu+3]
InChI
InChI=1S/3C11H20O2.Eu/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7,12H,1-6H3;/q;;;+3/p-3/b3*8-7-;
InChIKey
DVUACRCEVJAWMS-LWTKGLMZSA-K
Chemical Structure
2D Structure
2D structure of Tris(2,2,6,6-tetramethylheptane-3,5-dionato-O,O')europium
CAS: 15522-71-1
CID: 5486784
Formula: C33H57EuO6
MW: 701.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight701.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass702.33675
Monoisotopic Mass702.33675
Topological Polar Surface Area120 Ų
Heavy Atom Count40
Formal Charge0
Complexity199
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes