4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-Phenol

Catalog Number	ACM51094178-6
CAS	51094-17-8
Structure
Synonyms	5,10,15,20-Tetrakis(4-hydroxyphenyl)-21H,23H-porphine; 5,10,15,20-Tetrakis(4-hydroxyphenyl)porphyrin
IUPAC Name	4-[10,15,20-tris(4-hydroxyphenyl)-21,23-dihydroporphyrin-5-yl]phenol
Molecular Weight	678.73
Molecular Formula	C44H30N4O4
Canonical SMILES	C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)O)C8=CC=C(C=C8)O)C=C4)C9=CC=C(C=C9)O)N3)O
InChI	VFHDWGAEEDVVPD-UHFFFAOYSA-N
InChI Key	InChI=1S/C44H30N4O4/c49-29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(50)12-4-26)37-21-23-39(47-37)44(28-7-15-32(52)16-8-28)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(51)14-6-27/h1-24,45,48-52H
Melting Point	>300 °C-lit.
Purity	98%
Exact Mass	678.22670545
Heavy Atom Count	52
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	6
Monoisotopic Mass	678.22670545
Rotatable Bond Count	4
Topological Polar Surface Area	138 Ų