MedKoo Cat#: 161124 | Name: ZYM56818
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Description:

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

ZYM56818, also known as Fe(III) meso-Tetraphenylporphine Chloride (contains 1-3% chlorin) is an efficient catalyst for selective olefination of a variety of aldehydes with ethyl diazoacetate in the presence of triphenylphosphine. ZYM65818 is also an efficent catalyst in the oxidation of ketones in the presence of 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

ZYM56818
ZYM56818
CAS#16456-81-8

Theoretical Analysis

MedKoo Cat#: 161124

Name: ZYM56818

CAS#: 16456-81-8

Chemical Formula: C44H28ClFeN4

Exact Mass: 703.1352

Molecular Weight: 704.03

Elemental Analysis: C, 75.07; H, 4.01; Cl, 5.04; Fe, 7.93; N, 7.96

Price and Availability

Size Price Availability Quantity
100mg USD 420.00 2 Weeks
250mg USD 595.00 2 Weeks
500mg USD 810.00 2 Weeks
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Related CAS #
No Data
Synonym
ZYM56818; ZYM-56818; ZYM 56818; Fe(III) meso-Tetraphenylporphine Chloride (contains 1-3% chlorin); Fe (III) meso-Tetraphenylporphine Chloride (contains 1-3% chlorin);
IUPAC/Chemical Name
n/a
InChi Key
ZDYSAMCSFRQDMN-YKKPBKTHSA-M
InChi Code
InChI=1S/C44H28N4.ClH.Fe/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;;/h1-28H;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](N1/2)N3C(/C(C4=CC=CC=C4)=C5C=CC6=N/5)=CC=C3/C(C7=CC=CC=C7)=C8N=C(C=C\8)/C(C9=CC=CC=C9)=C1/C=CC2=C6/C%10=CC=CC=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 704.03 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.) Chen, et al. Iron(III) and Ruthenium(II) Porphyrin Complex-Catalyzed Selective Olefination of Aldehydes with Ethyl Diazoacetate. J. Org. Chem. 2003, 68, 9, 3714–3717 2.) Zhou, et al. Baeyer-Villiger oxidation of ketones catalyzed by iron(III) meso-tetraphenylporphyrin chloride in the presence of molecular oxygen. Journal of Porphyrins and Phthalocyanines Vol. 12, No. 02, pp. 94-100 (2008) 3.) Morandi, et al. Iron-Catalyzed Cyclopropanation with Trifluoroethylamine Hydrochloride and Olefins in Aqueous Media: In Situ Generation of Trifluoromethyl Diazomethane. Angewandte Chemie Int. Ed. Volume 49, Issue 5 January 25, 2010 Pages 938-941 4.) Baumann, et al. Iron Porphyrin Catalyzed N−H Insertion Reactions with Ethyl Diazoacetate. Organometallics 2007, 26, 16, 3995–4002