Zinc;1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;dihydrate

Catalog Number	ACM16743332-1
CAS	16743-33-2
Structure
Synonyms	Zinc 1,1,1,5,5,5-hexafluoro-4-oxo-2-penten-2-olate dihydrate
Molecular Weight	515.5
Molecular Formula	C10H6F12O6Zn
Canonical SMILES	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.O.O.[Zn+2]
InChI	InChI=1S/2C5H2F6O2.2H2O.Zn/c2*6-4(7,8)2(12)1-3(13)5(9,10)11;/h2*1,12H;2*1H2;/q;+2/p-2
InChI Key	HHDNHEKLDWSJAJ-UHFFFAOYSA-L
Melting Point	155 °C
Purity	98%
Appearance	Powder
Complexity	210
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	513.926418
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	18
Hydrogen Bond Donor Count	2
Monoisotopic Mass	513.926418
Rotatable Bond Count	2
Topological Polar Surface Area	82.3 Ų