5,10,15,20-Tetrakis(pentafluorophenyl)-21h,23h-porphine

Catalog Number	ACM25440146-4
CAS	25440-14-6
Structure
Synonyms	21H,23H-Porphine,5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)-
IUPAC Name	5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)-21,23-dihydroporphyrin
Molecular Weight	974.55
Molecular Formula	C44H10F20N4
Canonical SMILES	C1=CC2=C(C3=NC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C1N2)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C8=C(C(=C(C(=C8F)F)F)F)F)C=C3)C9=C(C(=C(C(=C9F)F)F)F)F
InChI	VJEVAXUMNMFKDT-UHFFFAOYSA-N
InChI Key	InChI=1S/C44H10F20N4/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50/h1-8,65,68H
Purity	98%
Appearance	Dark purple solid
Exact Mass	974.0586096
Heavy Atom Count	68
Hydrogen Bond Acceptor Count	22
Hydrogen Bond Donor Count	2
Monoisotopic Mass	974.0586096
Rotatable Bond Count	4
Topological Polar Surface Area	57.4 Ų