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304239

Benzotriazole-5-carboxylic acid

Name: Benzotriazole-5-carboxylic acid
Brand: ALDRICH

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About This Item

Empirical Formula (Hill Notation):

C₇H₅N₃O₂

CAS Number:

23814-12-2

Molecular Weight:

163.13

NACRES:

NA.22

PubChem Substance ID:

24858355

UNSPSC Code:

12352100

MDL number:

MFCD00012318

Assay:

99%

Form:

solid

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Properties

assay

99%

form

solid

functional group

carboxylic acid

SMILES string

OC(=O)c1ccc2[nH]nnc2c1

InChI

1S/C7H5N3O2/c11-7(12)4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)

InChI key

GUOVBFFLXKJFEE-UHFFFAOYSA-N

Gene Information

human ... GPR109B(8843)

Description

Application

Benzotriazole-5-carboxylic acid was used as bifunctional ligand in solvent induced synthesis of diverse dimensional coordination assemblies of cupric benzotriazole-5-carboxylate. It was also used in hydrothermal synthesis of new coordination polymer, [Zn(Btca)(Phen)]_n (H₂Btca = benzotriazole-5-carboxylic acid, Phen = 1,10-phenanthroline).

pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

ppe

dust mask type N95 (US), Eyeshields, Gloves

flash_point_f

No data available

flash_point_c

No data available

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Solvent induced diverse dimensional coordination assemblies of cupric benzotriazole-5-carboxylate: syntheses, crystal structures, and magnetic properties.

Juan Xiao et al.

Inorganic chemistry, 50(21), 11032-11038 (2011-10-11)

Three cupric coordination assemblies [Cu(btca)(H(2)O)(2)] (1), [Cu(btca)(H(2)O)(3.5)](8)·16H(2)O (2), and [Cu(2.5)(btca)(1.5)(Hbtca)(0.5)(μ-Cl)(0.5)(μ(3)-OH)(H(2)O)]·H(2)O (3) have been solvothermally synthesized by cupric salts and a bifunctional ligand benzotriazole-5-carboxylic acid (H(2)btca) in different solvent medium. These complexes were structurally characterized by X-ray diffraction analyses and further

Mechanism of retinoid X receptor partial agonistic action of 1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-2-naphthyl)-1H-benzotriazole-5-carboxylic acid and structural development to increase potency.

Fuminori Ohsawa et al.

Journal of medicinal chemistry, 56(5), 1865-1877 (2013-02-09)

We have reported that retinoid X receptor (RXR) partial agonist 1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-2-naphthyl)-1H-benzotriazole-5-carboxylic acid (CBt-PMN, 4a) shows a significant antidiabetes effect in the KK-A(y) type 2 diabetes model mice, with reduced side effects compared to RXR full agonists. To elucidate the mechanism

Hydrothermal synthesis and crystal structure of a new 2D metal-organic framework:[Zn (Btca)(Phen)] n (H2Btca= benzotriazole-5-carboxylic acid, phen= 1, 10-phenanthroline).

Lu RY and Han ZB.

Russian Journal of Coordination Chemistry, 37(3), 172-175 (2011)

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Global Trade Item Number

SKU	GTIN
304239-5G	04061833321355
304239-25G	04061826666821