(2,4-Dihydroxybenzoato-O1,O2)hydroxycopper

Catalog Number	ACM69868093-1
CAS	69868-09-3
Synonyms	Copper;2-carboxy-5-hydroxyphenolate;hydroxide
IUPAC Name	copper 2,4-dihydroxybenzoate hydroxide
Molecular Weight	233.67
Molecular Formula	C7H6CuO5
Canonical SMILES	C1=CC(=C(C=C1O)[O-])C(=O)O.[OH-].[Cu+2]
InChI	InChI=1S/C7H6O4.Cu.H2O/c8-4-1-2-5(7(10)11)6(9)3-4;/h1-3,8-9H,(H,10,11);1H2/q;+2;/p-2
InChI Key	MZCSXSKMYAZJHK-UHFFFAOYSA-L
Boiling Point	414.8ºC at 760 mmHg
Flash Point	218.8ºC
Purity	96%
EC Number	274-171-7
Exact Mass	232.95112
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Monoisotopic Mass	232.95112
Rotatable Bond Count	1
Topological Polar Surface Area	81.6 Ų