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D68002

Sigma-Aldrich

4,5-Dichloro-2-nitroaniline

96%

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About This Item

Linear Formula:
Cl2C6H2(NO2)NH2
CAS Number:
6641-64-1
Molecular Weight:
207.01
EC Number:
229-657-3
MDL number:
MFCD00007770
UNSPSC Code:
12352100
PubChem Substance ID:
24894053

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

signalword

Danger

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_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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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)

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