Cobalt(II) acetylacetonate hydrate

Catalog Number	ACM123334292-4
CAS	123334-29-2
Structure
Synonyms	Bis(2,4-pentanedionato)cobalt(II)
IUPAC Name	Cobalt;(Z)-4-hydroxypent-3-en-2-one;hydrate
Molecular Weight	277.18
Molecular Formula	C10H18CoO5
Canonical SMILES	CC(=CC(=O)C)O.CC(=CC(=O)C)O.O.[Co]
InChI	InChI=1S/2C5H8O2.Co.H₂O/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;1H2/b2*4-3-;
InChI Key	JHWSVOFBMAXGJH-SUKNRPLKSA-N
Melting Point	165-170 °C
Purity	95%+
Solubility	Slightly soluble in water
Appearance	Blue to black crystals
Complexity	239
Covalently-Bonded Unit Count	4
Exact Mass	277.048617
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isomeric SMILES	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.O.[Co]
Monoisotopic Mass	277.048617
Rotatable Bond Count	2
Topological Polar Surface Area	75.6 Ų