Basic red 18 (acetate)

CAT: 0804-HY-D1036Size: 1 EachDry Ice: NoHazardous: No

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Description

Basic red 18 (acetate) is an alkaline dye that can be removed from aqueous solutions in intermittent adsorption systems using tree ferns as biosorbents.

CAS Number

85187-95-7

UNSPSC

12171500

Hazard Statement

H302-H315-H319-H335

Target

Fluorescent Dye

Type

Dye Reagents

Related Pathways

Others

Field of Research

Others

Assay Protocol

https://www.medchemexpress.com/basic-red-18-acetate.html

Solubility

10 mM in DMSO

Smiles

CCN(CC[N+](C)(C)C)C1=CC=C(/N=N/C2=CC=C([N+]([O-])=O)C=C2Cl)C=C1.[O-]C(C)=O

Molecular Formula

C21H28ClN5O4

Molecular Weight

449.93

Precautions

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

References & Citations

[1]Ho Y S, Chiang T H, Hsueh Y M. Removal of basic dye from aqueous solution using tree fern as a biosorbent[J]. Process Biochemistry, 2005, 40 (1) : 119-124.

Shipping Conditions

Room temperature

Scientific Category

Dye Reagents

Clinical Information

No Development Reported

Chemical Information

Ethanaminium, 2-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)phenyl)ethylamino)-N,N,N-trimethyl-, acetate (1:1)

CAS Number	85187-95-7
PubChem CID	21149635
IUPAC Name	2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl-trimethylazanium acetate
Molecular Formula	C21H28ClN5O4
Molecular Weight	449.9
Topological Polar Surface Area	114
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	7
Heavy Atom Count	31
Formal Charge	0
Complexity	523

SMILES

CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.CC(=O)[O-]

InChI

InChI=1S/C19H25ClN5O2.C2H4O2/c1-5-23(12-13-25(2,3)4)16-8-6-15(7-9-16)21-22-19-11-10-17(24(26)27)14-18(19)20;1-2(3)4/h6-11,14H,5,12-13H2,1-4H3;1H3,(H,3,4)/q+1;/p-1

InChIKey

ICJCWNOPJWXPER-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 85187-95-7

CID: 21149635

Formula: C21H28ClN5O4

MW: 449.9

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	449.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	7
Exact Mass	449.1829821
Monoisotopic Mass	449.1829821
Topological Polar Surface Area	114 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	523
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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Basic red 18 (acetate)

Chemical Information

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