MedKoo Cat#: 161118 | Name: IYM13576
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

IYM13576, also known as Fe(III) meso-Tetra (p-hydroxyphenyl) Porphine Chloride is a synthetic porphyrin which is a catalyst in the hydroxylation of cyclohexane with molecular oxygen. This product has no formal name at the moment. For the convenience of communication, a temporal code name was therefore proposed according to MedKoo Chemical Nomenclature (see web page: https://www.medkoo.com/page/naming)

Chemical Structure

IYM13576
IYM13576
CAS#64413-57-6

Theoretical Analysis

MedKoo Cat#: 161118

Name: IYM13576

CAS#: 64413-57-6

Chemical Formula: C44H28ClFeN4O4

Exact Mass: 767.1149

Molecular Weight: 768.03

Elemental Analysis: C, 68.81; H, 3.67; Cl, 4.62; Fe, 7.27; N, 7.30; O, 8.33

Price and Availability

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50mg USD 650.00 2 Weeks
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Related CAS #
No Data
Synonym
IYM13576; IYM-13576; IYM 13576; Fe(III) meso-Tetra (p-hydroxyphenyl) Porphine Chloride; Fe (III) meso-Tetra (p-hydroxyphenyl) Porphine Chloride;
IUPAC/Chemical Name
n/a
InChi Key
IXKJWNOOTOTWQU-YKKPBKTHSA-M
InChi Code
InChI=1S/C44H28N4O4.ClH.Fe/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;;/h1-24H,(H4-2,45,46,47,48,49,50,51,52);1H;/q-2;;+3/p-1/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;
SMILES Code
Cl[Fe](N1/C(C=C/C1=C(C2=CC=C(C=C2)O)/C3=N/C(C=C3)=C4/C5=CC=C(C=C5)O)=C6/C7=CC=C(C=C7)O)N8C4=CC=C8/C(C9=CC=C(C=C9)O)=C%10N=C6C=C\%10
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 -4 C for short term (days to weeks) or -20 C for long term(months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 768.03 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1.) Liu, et al. The preparation of some polystyrene-supported porphyrinatoiron(III) and their catalysis in hydroxylation of cyclohexane with molecular oxygen. Journal of Molecular Catalysis A: Chemical. Volume 104, Issue 3, 10 January 1996, Pages L193-L196. https://doi.org/10.1016/1381-1169(95)00253-7