5,10,15,20-Tetra(4-methylphenyl)-21H,23H-porphine manganese(III) chloride

Catalog Number	ACM43145444-1
CAS	43145-44-4
Structure
Synonyms	Manganese(3+);5,10,15,20-tetrakis(4-methylphenyl)porphyrin-22,24-diide;chloride
Molecular Weight	759.2
Molecular Formula	C48H36ClMnN4
Canonical SMILES	CC1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C)C8=CC=C(C=C8)C)C=C4)C9=CC=C(C=C9)C)[N-]3.[Cl-].[Mn+3]
InChI	InChI=1S/C48H36N4.ClH.Mn/c1-29-5-13-33(14-6-29)45-37-21-23-39(49-37)46(34-15-7-30(2)8-16-34)41-25-27-43(51-41)48(36-19-11-32(4)12-20-36)44-28-26-42(52-44)47(40-24-22-38(45)50-40)35-17-9-31(3)10-18-35;/h5-28H,1-4H3;1H;/q-2;+3/p-1
InChI Key	ZBGWSPAMNFXKGA-UHFFFAOYSA-M
Purity	95%+
Exact Mass	758.200893
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Monoisotopic Mass	758.200893
Rotatable Bond Count	4
Topological Polar Surface Area	27.8 Ų