AG003P1W

86233-74-1 | Copper(I) Hexafluoro-2,4-pentanedionate 1,5-Cyclooctadiene Complex

AG003P1W

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CAS Number	86233-74-1
Catalog Number	AG003P1W(AGN-PC-0V3794)
Chemical Name	Copper(I) Hexafluoro-2,4-pentanedionate 1,5-Cyclooctadiene Complex
IUPAC Name	copper;cyclooctane;(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one
InChI	InChI=1S/C8H12.C5H2F6O2.Cu/c1-2-4-6-8-7-5-3-1;6-4(7,8)2(12)1-3(13)5(9,10)11;/h1-2,7-8H,3-6H2;1,12H;/b;2-1-;
InChI Key	WSAPIYREFIKPSH-FJOGWHKWSA-N
MDL Number	MFCD00156517
Molecular Formula	C13H13CuF6O2
Molecular Weight	378.7775
SMILES	FC(F)(/C(O[Cu])=C/C(C(F)(F)F)=O)F.C1=CCC/C=CCC/1
Synonyms	86233-74-1, MFCD00156517, Copper(I) hexafluoroacetylacetonate cyclooctadiene complex, Copper(i)hexafluoro-2,4-pentanedionate-cyclooctadiene complex, COPPER(I) HEXAFLUORO-2,4-PENTANEDIONATE-CYCLOOCTADIENE COMPLEX, 1,5-Cyclooctadiene(hexafluoro-2,4-pentanedionato)copper(I),

Complexity	272
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	379.019g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	379.789g/mol
Monoisotopic Mass	379.019g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P280g-P305+P351+P338
UN Code

Certificate of Analysis

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