MedKoo Cat#: 161201 | Name: KDL99927
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Description:

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

KDL99927, also known as Ni (II) meso-Tetra(4-carboxyphenyl) porphine is a synthetic porphyrin product seen to improve the oxidation of water in a WO3/TiO2Photoanode. 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

KDL99927
KDL99927
CAS#41699-92-7

Theoretical Analysis

MedKoo Cat#: 161201

Name: KDL99927

CAS#: 41699-92-7

Chemical Formula: C48H28N4NiO8

Exact Mass: 846.1261

Molecular Weight: 847.47

Elemental Analysis: C, 68.03; H, 3.33; N, 6.61; Ni, 6.93; O, 15.10

Price and Availability

Size Price Availability Quantity
50mg USD 520.00 2 Weeks
100mg USD 770.00 2 Weeks
250mg USD 1,170.00 2 Weeks
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Related CAS #
No Data
Synonym
KDL99927; KDL99927; KDL99927; Ni (II) meso-Tetra(4-carboxyphenyl) porphine;
IUPAC/Chemical Name
n/a
InChi Key
KRJLBWKAYPGJOF-DAJBKUBHSA-L
InChi Code
InChI=1S/C48H30N4O8.Ni/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58;/h1-24H,(H6,49,50,51,52,53,54,55,56,57,58,59,60);/q;+2/p-2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;
SMILES Code
O=C(O)C(C=C1)=CC=C1/C(C2=CC=C3/C(C4=CC=C(C(O)=O)C=C4)=C(C=C5)\N=C5/C(C6=CC=C(C(O)=O)C=C6)=C7N8[Ni]N23)=C9N=C(/C(C%10=CC=C(C(O)=O)C=C%10)=C8/C=C\7)C=C/9
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 847.47 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.) Jafarian, et al. A comparative investigation of the electrocatalytic oxidation of methanol on poly-NiTCPP and poly-TCPP/Ni modified glassy carbon electrodes. Journal of Electroanalytical Chemistry. Volume 663, Issue 1, 1 December 2011, Pages 14-23. https://doi.org/10.1016/j.jelechem.2011.09.018 2.) Wei, et al. Photoelectrochemical Performance for Water Oxidation Improved by Molecular Nickel Porphyrin-Integrated WO3/TiO2Photoanode. ChemSusChem. Volume 11, Issue 11, June 11, 2018, Pages 1746-1750. https://doi.org/10.1002/cssc.201800705 3.) Achey, et al. Ligand Coordination and Spin Crossover in a Nickel Porphyrin Anchored to Mesoporous TiO2 Thin Films. Inorg. Chem. 2013, 52, 16, 9574–9582. https://doi.org/10.1021/ic401286a