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

Catalog NumberACM51094178-1

CAS Number51094-17-8

CategoryPorphyrin-A4-porphyrin

Phenol, 4, 4', 4'', 4'''- (21H, 23H- porphine- 5, 10, 15, 20- tetrayl) tetrakis-
Synonyms
4,​4',​4'',​4'''-​(21H,​23H-​porphine-​5,​10,​15,​20-​tetrayl)​tetrakis-Phenol
IUPAC Name
4-[10,15,20-tris(4-hydroxyphenyl)-21,23-dihydroporphyrin-5-yl]phenol
Molecular Weight
678.7g/mol
Molecular Formula
C44H30N4O4
InChI
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
InChI Key
VFHDWGAEEDVVPD-UHFFFAOYSA-N
Purity
95%
Appearance
51094-17-8
Complexity
973
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
678.22670545g/mol
Formal Charge
0
Heavy Atom Count
52
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
6
Isotope Atom Count
0
MeSH Entry Terms
4-hydroxyphenyl-porphyrin;4-hydroxyphenylporphyrin;5,10,15,20-tetra(4-hydroxyphenyl)porphyrin;5,10,15,20-tetrakis(4-hydroxyphenyl)porphyrin;5,10,15,20-tetrakis-(4-hydroxyphenyl)-21H,23H-porphyrin;para-THPP;tetra(p-hydroxyphenyl)porphyrin;THPP porphyrin
Monoisotopic Mass
678.22670545g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
138Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
9
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