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Substance Name: 2,3,7,8,12,13,17,18-Octabromo-5,10,15,20-tetrakis(pentafluorophenyl)porphyrinato-iron(III)
RN: 131917-66-3
InChIKey: LSSGEFCLQYOSQT-POHCQIEOSA-M

Note

  • A catalyst for hydroxylation of light alkanes by oxygen.

Molecular Weight

  • 1695.002
 
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Names and Synonyms

Name of Substance

  • 2,3,7,8,12,13,17,18-Octabromo-5,10,15,20-tetrakis(pentafluorophenyl)porphyrinato-iron(III)

Synonym

  • Fe(Tfppbr(8))Cl

Registry Numbers

CAS Registry Number

  • 131917-66-3

System Generated Number

  • 0131917663

Structure Descriptors

InChI

1S/C44Br8F20N4.ClH.Fe/c45-9-11(47)39-6(2-19(55)27(63)34(70)28(64)20(2)56)41-13(49)15(51)43(75-41)8(4-23(59)31(67)36(72)32(68)24(4)60)44-16(52)14(50)42(76-44)7(3-21(57)29(65)35(71)30(66)22(3)58)40-12(48)10(46)38(74-40)5(37(9)73-39)1-17(53)25(61)33(69)26(62)18(1)54;;/h;1H;/q-2;;+3/p-1/b37-5-,38-5-,39-6-,40-7-,41-6-,42-7-,43-8-,44-8-;;

InChIKey

LSSGEFCLQYOSQT-POHCQIEOSA-M

Smiles

c\1(c/2\nc(/c(c/3\[n-]/c(/c(c3Br)Br)c(\c4n/c(c(\c5[n-]c1c(c5Br)Br)/c6c(c(c(c(c6F)F)F)F)F)/C(=C4Br)Br)/c7c(c(c(c(c7F)F)F)F)F)/c8c(c(c(c(c8F)F)F)F)F)C(=C2Br)Br)/c9c(c(c(c(c9F)F)F)F)F.[Cl-].[Fe+3]