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Structure

Quinolinium,1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-,iodide(1:1)

CAS
977-96-8
Catalog Number
ACM977968
Category
Other Products
Molecular Weight
327.4416
Molecular Formula
C23H23N2.I

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Specification

Synonyms
1,1-DIETHYL-2,2-CYANINE IODIDE; 1,1-Diethyl-2,2-cyanine Iodide;
IUPAC Name
1-ethyl-2-[(E)-(1-ethylquinolin-2-ylidene)methyl]quinolin-1-ium iodide
InChI Key
GMYRVMSXMHEDTL-UHFFFAOYSA-M
Melting Point
273ºC
Appearance
dark red crystals
Exact Mass
454.09100
Hazard Statements
T: Toxic;
H-Bond Acceptor
2
H-Bond Donor
0
Packing Group
II
Safety Description
45
What is the molecular formula of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The molecular formula is C23H23IN2.

What is the molecular weight of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The molecular weight is 454.3 g/mol.

What is the IUPAC name of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The IUPAC name is (2E)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline;iodide.

What is the InChI representation of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The InChI representation is InChI=1S/C23H23N2.HI/c1-3-24-20(15-13-18-9-5-7-11-22(18)24)17-21-16-14-19-10-6-8-12-23(19)25(21)4-2;/h5-17H,3-4H2,1-2H3;1H/q+1;/p-1.

What is the InChIKey of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The InChIKey is GMYRVMSXMHEDTL-UHFFFAOYSA-M.

What is the canonical SMILES of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The canonical SMILES is CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[I-].

What are the synonyms of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The synonyms are 977-96-8, Decynium 22, 1,1'-Diethyl-2,2'-cyanine iodide, Pseudoisocyanine iodide, Pseudoisocyanin, and more.

What is the CAS number of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The CAS number is 977-96-8.

What is the complexity of Quinolinium, 1-ethyl-2-[(1-ethyl-2(1H)-quinolinylidene)methyl]-, iodide?

The complexity is 464.

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