YJN95527 | CAS# 253195-52-7 | Synthetic porphyrin

MedKoo Cat#: 161145 | Name: YJN95527

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Description:

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

YJN95527, also known as meso-Tetra (3,5-dicarboxyphenyl) Porphine is a synthetic porphyrin product. YJN95527 exhibits amido-imidol tautomerism in DMSO-d6. YJN95527 is used to form heteroporphyrin arrays in aqueous solution. 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

YJN95527

CAS#253195-52-7

Theoretical Analysis

MedKoo Cat#: 161145

Name: YJN95527

CAS#: 253195-52-7

Chemical Formula: C52H30N4O16

Exact Mass: 966.1657

Molecular Weight: 966.82

Elemental Analysis: C, 64.60; H, 3.13; N, 5.80; O, 26.48

Price and Availability

Size	Price	Availability	Quantity
50mg	USD 650.00	2 Weeks
100mg	USD 1,000.00	2 Weeks

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Related CAS #

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Synonym

YJN95527; YJN-95527; YJN 95527; meso-Tetra (3,5-dicarboxyphenyl) Porphine; meso-Tetra(3,5-dicarboxyphenyl) Porphine;

IUPAC/Chemical Name

5,5',5'',5'''-(porphyrin-5,10,15,20-tetrayl)tetraisophthalic acid

InChi Key

YVFJQTIHIUPFOR-JAAFTSFNSA-N

InChi Code

InChI=1S/C52H30N4O16/c57-45(58)25-9-21(10-26(17-25)46(59)60)41-33-1-2-34(53-33)42(22-11-27(47(61)62)18-28(12-22)48(63)64)36-5-6-38(55-36)44(24-15-31(51(69)70)20-32(16-24)52(71)72)40-8-7-39(56-40)43(37-4-3-35(41)54-37)23-13-29(49(65)66)19-30(14-23)50(67)68/h1-20,53,56H,(H,57,58)(H,59,60)(H,61,62)(H,63,64)(H,65,66)(H,67,68)(H,69,70)(H,71,72)/b41-33-,41-35-,42-34-,42-36-,43-37-,43-39-,44-38-,44-40-

SMILES Code

O=C(C1=CC(C(O)=O)=CC(/C2=C(N/3)\C=CC3=C(C(C=C/4)=NC4=C(C5=CC=C(/C(C6=CC(C(O)=O)=CC(C(O)=O)=C6)=C7N=C2C=C\7)N5)\C8=CC(C(O)=O)=CC(C(O)=O)=C8)/C9=CC(C(O)=O)=CC(C(O)=O)=C9)=C1)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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 966.82 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.

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: Yadav, et al. Facile synthesis, photophysical and electrochemical redox properties of octa- and tetracarboxamidophenylporphyrins and the first example of amido-imidol tautomerism in porphyrins. Dyes and Pigments. Volume 139, April 2017, Pages 651-657. https://doi.org/10.1016/j.dyepig.2016.10.053 2: Kano, et al. Convenient Scaffold for Forming Heteroporphyrin Arrays in Aqueous Media. J. Am. Chem. Soc. 2003, 125, 35, 10625–10634. https://doi.org/10.1021/ja035055q