Magnesium meso-tetraphenylporphine

Catalog Number	ACM24968227
CAS	24968-22-7
Synonyms	Magnesium;5,10,15,20-tetraphenylporphyrin-22,24-diide;hydrate
Molecular Weight	655.04
Molecular Formula	C44H30MgN4O
Canonical SMILES	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.O.[Mg+2]
InChI	InChI=1S/C44H28N4.Mg.H2O/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;/h1-28H;1H2/q-2;+2;
InChI Key	VTAVIQZTEKZUJO-UHFFFAOYSA-N
Purity	97%
Exact Mass	654.2270033
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Monoisotopic Mass	654.2270033
Rotatable Bond Count	4
Topological Polar Surface Area	27.7 Ų