Cobaltiprotoporphyrin

Catalog Number	ACM14325032-1
CAS	14325-03-2
Synonyms	3-[18-(2-Carboxylatoethyl)-7,12-bis(ethenyl)-3,8,13,17-tetramethylporphyrin-21,23-diid-2-yl]propanoate;cobalt(2+);hydron
Molecular Weight	619.6
Molecular Formula	C34H32CoN4O4
Canonical SMILES	[H+].[H+].CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C(=C3CCC(=O)[O-])C)CCC(=O)[O-].[Co+2]
InChI	InChI=1S/C34H34N4O4.Co/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2
InChI Key	AQTFKGDWFRRIHR-UHFFFAOYSA-L
Purity	99%
Exact Mass	619.175549
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
Monoisotopic Mass	619.175549
Rotatable Bond Count	6
Topological Polar Surface Area	107 Ų