MedKoo Cat#: 161195 | Name: XTM63171
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Description:

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

XTM63171, also known as Mn(III) meso-Tetra (o-dichlorophenyl) porphine chloride is a synthetic porphyrin derivative. XTM63171 is used as a catalyst in the oxidation of hydrocarbons. XTM63171 is a potential catalyst for olefin epoxidations and aromatic hydroxylations. 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

XTM63171
XTM63171
CAS#91463-17-1

Theoretical Analysis

MedKoo Cat#: 161195

Name: XTM63171

CAS#: 91463-17-1

Chemical Formula: C44H20Cl9MnN4

Exact Mass: 973.8265

Molecular Weight: 978.66

Elemental Analysis: C, 54.00; H, 2.06; Cl, 32.60; Mn, 5.61; N, 5.72

Price and Availability

Size Price Availability Quantity
100mg USD 555.00 2 Weeks
250mg USD 830.00 2 Weeks
500mg USD 1,220.00 2 Weeks
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Related CAS #
No Data
Synonym
XTM63171; XTM-63171; XTM 63171; Mn(III) meso-Tetra (o-dichlorophenyl) porphine chloride;
IUPAC/Chemical Name
n/a
InChi Key
XMSVTEHTHSQSPR-TXFZNMFQSA-M
InChi Code
InChI=1S/C44H20Cl8N4.ClH.Mn/c45-21-5-1-6-22(46)37(21)41-29-13-15-31(53-29)42(38-23(47)7-2-8-24(38)48)33-17-19-35(55-33)44(40-27(51)11-4-12-28(40)52)36-20-18-34(56-36)43(32-16-14-30(41)54-32)39-25(49)9-3-10-26(39)50;;/h1-20H;1H;/q-2;;+3/p-1/b41-29+,41-30+,42-31+,42-33+,43-32+,43-34+,44-35+,44-36+;;
SMILES Code
ClC1=C(/C(C(C=C/2)=NC2=C3C4=C(C=CC=C4Cl)Cl)=C5C=C/C6=C(C7=N/C(C=C7)=C(C8=CC=C\3N8[Mn](N\56)Cl)/C9=C(C=CC=C9Cl)Cl)\C%10=C(C=CC=C%10Cl)Cl)C(Cl)=CC=C1
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 978.66 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.) Battioni, et al. Monooxygenase-like Oxidation of Hydrocarbons by H2O2 Catalyzed by Manganese Pophyrins and Imidazole: Selection of the Best Catalytic System and Nature of the Active Oxygen Species. Journal of the American Chemical Society, 1988, vol. 110, # 25, p. 8462 – 8470. https://doi.org/10.1021/ja00233a023 2.) Mansuy, et al. Highly oxidation resistant inorganic-porphyrin analogue polyoxometalate oxidation catalysts. 2. Catalysis of olefin epoxidation and aliphatic and aromatic hydroxylations starting from α2-P2W17O61(M n+·Br)(n-11) (Mn+ = Mn3+, Fe3+, Co2+, Ni2+, Cu2+). Journal of the American Chemical Society, 1991, vol. 113, # 19, p. 7222 – 7226. https://doi.org/10.1021/ja00019a019 3.) Chan, et al. Oxidative amide synthesis and N-terminal α-amino group ligation of peptides in aqueous medium. Journal of the American Chemical Society, 2006, vol. 128, # 46, p. 14796 – 14797. https://doi.org/10.1021/ja064479s