MedKoo Cat#: 161031 | Name: XAK37272
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Description:

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

XAK37272, also known as Fe(III) Coproporphyrin I chloride, is a pyrrole based product that is used in organic compound synthesis. Coproporphyrins and their metal ligands also are used as sensitizers in solar cells and as biomarkers in kidney function research. 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

XAK37272
XAK37272
CAS#210537-27-2

Theoretical Analysis

MedKoo Cat#: 161031

Name: XAK37272

CAS#: 210537-27-2

Chemical Formula: C36H36ClFeN4O8

Exact Mass: 743.1600

Molecular Weight: 744.00

Elemental Analysis: C, 58.12; H, 4.88; Cl, 4.76; Fe, 7.51; N, 7.53; O, 17.20

Price and Availability

Size Price Availability Quantity
10mg USD 661.00 2 Weeks
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Related CAS #
No Data
Synonym
XAK37272; XAK-37272; XAK 37272; Fe(III) Coproporphyrin I chloride;
IUPAC/Chemical Name
n/a
InChi Key
XYCINZZKAPOMLR-ARSPAUKVSA-K
InChi Code
InChI=1S/C36H38N4O8.ClH.Fe/c1-17-21(5-9-33(41)42)29-14-26-19(3)23(7-11-35(45)46)31(39-26)16-28-20(4)24(8-12-36(47)48)32(40-28)15-27-18(2)22(6-10-34(43)44)30(38-27)13-25(17)37-29;;/h13-16H,5-12H2,1-4H3,(H6,37,38,39,40,41,42,43,44,45,46,47,48);1H;/q;;+3/p-3/b25-13-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15-;;
SMILES Code
OC(CCC1=C(/C=C2C(C)=C(CCC(O)=O)C(/C=C(N/3[Fe]4Cl)/C(C)=C(CCC(O)=O)C3=C\C5=N/C(C(CCC(O)=O)=C5C)=C\6)=N/2)N4C6=C1C)=O
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 744.00 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) Enthaler, Stephan; Erre, Giulia; Tse, Man Kin; Junge, Kathrin; Beller, Matthias, Biomimetic transfer hydrogenation of ketones with iron porphyrin catalysts, Tetrahedron Letters (2006), 47(46), 8095-8099. 2) Vedadi, Masoud; Niesen, Frank H.; Allali-Hassani, Abdellah; Fedorov, Oleg Y.; Finerty, Patrick J., Jr.; Wasney, Gregory A.; Yeung, Ron; Arrowsmith, Cheryl; Ball, Linda J.; Berglund, Helena; et al, Chemical screening methods to identify ligands that promote protein stability, protein crystallization, and structure determination, Proceedings of the National Academy of Sciences of the United States of America (2006), 103(43), 15835-15840. 3) Alibabaei, Leila; Wang, Mingkui; Giovannetti, Rita; Teuscher, Joel; di Censo, Davide; Moser, Jacques-E.; Comte, Pascal; Pucciarelli, Filippo; Zakeeruddin, Shaik M.; Gratzel, Michael, Application of Cu(II) and Zn(II) coproporphyrins as sensitizers for thin film dye sensitized solar cell, Energy & Environmental Science (2010), 3(7), 956-961. 4) Li, Jinhua; Cai, Zongwei, Stacking and separation of urinary porphyrins in capillary electrophoresis: Optimization of concentration efficiency and resolution, Talanta (2008), 77(1), 331-339.