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Substance Name: Ferric oxochlorin
RN: 117828-52-1
InChIKey: UOLSFSCUPLGSPR-UHFFFAOYSA-K

Molecular Weight

  • 607.4649
 
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Names and Synonyms

Name of Substance

  • Ferric oxochlorin

Synonym

  • Iron(III) oxochlorin

Registry Numbers

CAS Registry Number

  • 117828-52-1

System Generated Number

  • 0117828521

Structure Descriptors

InChI

1S/C32H34N4O5.Fe/c1-15-16(2)24-14-28-32(5,6)31(41)27(36-28)12-23-18(4)20(8-10-30(39)40)26(35-23)13-25-19(7-9-29(37)38)17(3)22(34-25)11-21(15)33-24;/h11-14H,7-10H2,1-6H3,(H4,33,34,35,36,37,38,39,40,41);/q;+3/p-3

InChIKey

UOLSFSCUPLGSPR-UHFFFAOYSA-K

Smiles

[H+].Cc1c(c2/cc/3\nc(/cc\4/c(c(/c(/[n-]4)c/c5n/c(c\c1[n-]2)/C(=C5CCC(=O)[O-])C)CCC(=O)[O-])C)C(=O)C3(C)C)C.[Fe+3]