Bis(1-pyrenylmethyl) Ether - ≥98% , CAS No.74833-81-1

CAS: 74833-81-1 Cat. No.: B334401 Molecular Weight: 446.54

GRADE & PURITY ≥98%

Synonyms

AKOS030240041 | DTXSID80225810 | 1-(pyren-1-ylmethoxymethyl)pyrene | Di-(1-pyrenylmethyl)ether | Bis(1-pyrenylmethyl) Ether | Pych2OCH2Py | FT-0663386 | Pyrene,1,1'-[oxybis(methylene)]bis- | 1,1'-[Oxybis(methylene)]bis-pyrene | DPYME | HY-147170 | Bis(1-p

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Bis(1-pyrenylmethyl) Ether is a hydrophobic fluorescent probe exhibiting intramolecular excimer fluorescence, competing with fluorescence from locally excited pyrene chromophore.

Specifications

Synonyms

AKOS030240041 | DTXSID80225810 | 1-(pyren-1-ylmethoxymethyl)pyrene | Di-(1-pyrenylmethyl)ether | Bis(1-pyrenylmethyl) Ether | Pych2OCH2Py | FT-0663386 | Pyrene, 1, 1'-[oxybis(methylene)]bis- | 1, 1'-[Oxybis(methylene)]bis-pyrene | DPYME | HY-147170 | Bis(1-p

Specifications & Purity

≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Product Properties

• Excitation and Emision Ranges: λex 345 nm,λem 490 nm in aqueous poly(N-isopropylacrylamide PNIPAM)

Names and Identifiers

• Pubchem Sid: 488188478
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188478
• Canonical Smiles: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)COCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5
• IUPAC Name: 1-(pyren-1-ylmethoxymethyl)pyrene
• InChIKey: KDWSQWLDGXGQTK-UHFFFAOYSA-N
• INCHI: 1S/C34H22O/c1-3-21-7-9-25-11-13-27(29-17-15-23(5-1)31(21)33(25)29)19-35-20-28-14-12-26-10-8-22-4-2-6-24-16-18-30(28)34(26)32(22)24/h1-18H,19-20H2
• Isomeric SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)COCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5
• Molecular Weight: 446.54
• Reaxy-Rn: 6009033
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6009033&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Pyrenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Pyrenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrenes
• Alternative Parents: Phenanthrenes and derivatives Naphthalenes Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Pyrene - Phenanthrene - Naphthalene - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
• External Descriptors: Not available

Data sources

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

Chemical and Physical Properties

• Solubility: Soluble in Acetone and Ethanol
• Melt Point(°C): 169-170° C
• Molecular Weight: 446.500 g/mol
• XLogP3: 9.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 446.167 Da
• Monoisotopic Mass: 446.167 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 698.000
• 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