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2,3,7,8,12,13,17,18-Octaethylporphyrin - 95%, high purity , CAS No.2683-82-1

COA

Grade & Purity:

≥95%

Cas Number: 2683-82-1
Molecular Weight: 534.79
Beilstein Registry Number: 26(3/4)1925
MDL number: MFCD00009627
PubChem CID: 102311

In stock

Item Number

O159904

Grouped product items
SKU	Size	Availability	Price
O159904-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$79.90
O159904-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$167.90
O159904-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$599.90

View related series

Glucose Metabolism (1943) Material synthetic block (276) Nitrogen donating ligand (229) optical materials (3) photonic materials (3) Phthalocyanine Ligands (3) Porphyrin Ligands (7)

Basic Description

Synonyms	Octaethylporphine \| 2,3,7,8,12,13,17,18-octaethylporphyrin \| 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine \| Octaethylporphyrin \| 2,3,7,8,12,13,17,18-octaethyl-21,22-dihydroporphyrin
Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Product description Metalated and metal free 2,3,7,8,12,13,17,18-octaethyl- 21H,23H-porphine (OEP) can form Langmuir Blodgett (LB) thin films. OEP has gas sensing properties.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Tetrapyrroles and derivatives
    - Subclass Porphyrins

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Tetrapyrroles and derivatives
Subclass	Porphyrins
Intermediate Tree Nodes	Not available
Direct Parent	Porphyrins
Alternative Parents	Substituted pyrroles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Porphyrin - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as porphyrins. These are compounds containing a fundamental skeleton of four pyrrole nuclei united through the alpha-positions by four methine groups to form a macrocyclic structure.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	2,3,7,8,12,13,17,18-octaethyl-21,22-dihydroporphyrin
INCHI	InChI=1S/C36H46N4/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30/h17-20,37-38H,9-16H2,1-8H3
InChIKey	XFIIGRBIXXECHR-UHFFFAOYSA-N
Smiles	CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CC
Isomeric SMILES	CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CC
PubChem CID	102311
Molecular Weight	534.79
Beilstein	26(3/4)1925
Reaxy-Rn	379798

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Sensitivity	Light Sensitive,Air Sensitive
Molecular Weight	534.800 g/mol
XLogP3	8.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	8
Exact Mass	534.372 Da
Monoisotopic Mass	534.372 Da
Topological Polar Surface Area	57.400 Å²
Heavy Atom Count	40
Formal Charge	0
Complexity	725.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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