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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) | CAS No. 3546-41-6

Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate)

Basic Information

Chemical_Structure_Of
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CAS Number

3546-41-6

Molecular Formula

C75H70N6O6

Molecular Weight

1151.4 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

210-215 ºC

Boiling Point

829.27°C (rough estimate)

Solubility

DMSO: >10mg/mL

Refractive Index

1.6400 (estimate)

SMILES

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CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)N(C)C)C.CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)N(C)C)C.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O

InChI

InChI=1S/2C26H28N3.C23H16O6/c2*1-19-17-21(20(2)29(19)24-9-7-6-8-10-24)11-13-23-14-12-22-18-25(27(3)4)15-16-26(22)28(23)5;24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29/h2*6-18H,1-5H3;1-10,24-25H,11H2,(H,26,27)(H,28,29)/q2*+1;/p-2

InChIKey

OOPDAHSJBRZRPH-UHFFFAOYSA-L

LogP

12.33840

Complexity

1120

Synonyms & References

English

  • 2-NAPHTHOIC ACID, 4,4'-METHYLENEBIS(3-HYDROXY-, ION(2-), BIS(6-(DIMETHYLAMINO)-2-(2-(2,5-DIMETHYL-1-PHENYLPYRROL-3-YL)VINYL)-1-METHYLQUINOLINIUM)
  • CS-6311
  • Pyrvinium embonate
  • DTXCID503545
  • 2412580-82-4
  • BIS(6-(DIMETHYLAMINO)-2-(2-(2,5-DIMETHYL-1-PHENYLPYRROL-3-YL)VINYL)-1-METHYLQUINOLINIUM) 4,4'-METHYLENEBIS(3-HYDROXY-2-NAPHTHOATE)
  • Vipyrvinium embonate
  • Tox21_110753
  • 3546-41-6
  • VEO-OXYPATE
  • QUINOLINIUM, 6-(DIMETHYLAMINO)-2-(2-(2,5-DIMETHYL-1-PHENYLPYRROL-3-YL)VINYL)-1-METHYL-, SALT WITH 4,4`-METHYLENEBIS(3-HYDROXY-2-NAPHTHOIC ACID) (2:1)
  • CHEMBL1908377
  • SR-01000872694-1
  • CHEBI:8688
  • DTXSID4023545
  • Pyrvinium (as embonate)
  • Dipyrivinium Pamoate
  • bis(2-[(1E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl]-6-(dimethylamino)-1-methylquinolin-1-ium) 4-[(3-carboxylato-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylate
  • MFCD00010090
  • D00489
  • bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl]-1-methylquinolinium} 4,4'-methanediylbis(3-hydroxynaphthalene-2-carboxylate)
  • NCGC00017042-01
  • EN300-1273052
  • 4-[(3-carboxylato-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylate; 2-[(E)-2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)vinyl]-N,N,1-trimethyl-quinolin-1-ium-6-amine
  • Vanquil
  • EX-A4867
  • Vermitibier
  • Z2196311755
  • NEO-OXYPAAT
  • Povan (TN)
  • AS-56860

MDL Number

MFCD00010090

FAQ

What are the physical and chemical properties of Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) (CAS: 3546-41-6)?
This compound exhibits crystalline properties with a high molecular weight, showing moderate solubility in organic solvents. It is reactive towards nucleophiles and displays a high selectivity in specific chemical reactions. The compound's stability and reactivity are critical for its applications in various industries.

How is Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) (CAS: 3546-41-6) typically synthesized?
The compound is synthesized via a multi-step process involving the coupling of quinoline derivatives with vinyl-substituted pyrrole, followed by the formation of the bis-3-hydroxy-2-naphthoate linkage. The reaction conditions include the use of a palladium catalyst and controlled temperature to ensure high yield and selectivity.

What industries use Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) (CAS: 3546-41-6)?
This compound is utilized in pharmaceuticals for its bioavailability and in sensors for its optical properties. It is also explored in semiconductor applications for its electronic conductivity and in polymer industries for its structural integrity.

What precautions should be taken when handling Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) (CAS: 3546-41-6)?
Handle this compound in a fume hood with appropriate personal protective equipment (PPE), including gloves and a lab coat. Ensure proper spill containment and disposal according to safety data sheet (SDS) guidelines to avoid exposure and environmental contamination.

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Changzhou Xinxin Chemical Technology Co., Ltd.

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SiChuanWeiKeJi Biotechnology Co Ltd

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — ShangHaiJiZhiShengHua Technology Co Ltd

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — ShangHaiChuangSai Technology Co Ltd

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — MedChemExpress LLC

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — HePeng （ ShangHai ） Biotechnology Co Ltd

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — Shanghai Yuyeh Biotechnology Co., Ltd.

Shanghai Yuyeh Biotechnology Co., Ltd.

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Bis{6-(dimethylamino)-2-[(E)-2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium} 4,4'-methylenebis(3-hydroxy-2-naphthoate) — JiangSuAiKangShengWuYiYaoYanFa Co Ltd

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