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D68002

4,5-Dichloro-2-nitroaniline

Name: 4,5-Dichloro-2-nitroaniline
Brand: ALDRICH

96%

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About This Item

Linear Formula:

Cl₂C₆H₂(NO₂)NH₂

CAS Number:

6641-64-1

Molecular Weight:

207.01

UNSPSC Code:

12352100

PubChem Substance ID:

24894053

EC Number:

229-657-3

MDL number:

MFCD00007770

Assay:

96%

Form:

powder

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Properties

assay

96%

form

powder

mp

177-179 °C (lit.)

SMILES string

Nc1cc(Cl)c(Cl)cc1[N+]([O-])=O

InChI

1S/C6H4Cl2N2O2/c7-3-1-5(9)6(10(11)12)2-4(3)8/h1-2H,9H2

InChI key

FSGTULQLEVAYRS-UHFFFAOYSA-N

Description

pictograms

GHS06,GHS08,GHS09

signalword

Danger

hcodes

H300 + H310 + H330,H373,H411

pcodes

P262 - P273 - P280 - P301 + P310 + P330 - P302 + P352 + P310 - P304 + P340 + P310

Hazard Classifications

Acute Tox. 1 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Aquatic Chronic 2 - STOT RE 2

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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A competition between hydrophobic and electrostatic interactions in protein-ligand systems. Binding of heterogeneously halogenated benzotriazoles by the catalytic subunit of human protein kinase CK2.

Sławomir Kasperowicz et al.

IUBMB life, 72(6), 1211-1219 (2020-03-13)

A series of chlorine-substituted benzotriazole derivatives, representing all possible substitution patterns of halogen atoms attached to the benzotriazole benzene ring, were synthetized as potential inhibitors of human protein kinase CK2. Basic ADME parameters for the free solutes (hydrophobicity, electronic properties)

Global Trade Item Number

SKU	GTIN
D68002-10G	04061833587904