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Merck
CN

79874

2-Chloro-1,3,5-trinitrobenzene

≥98.0% (HPLC)

Synonym(s):

2,4,6-Trinitrochlorobenzene

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About This Item

Empirical Formula (Hill Notation):
C6H2ClN3O6
CAS Number:
88-88-0
Molecular Weight:
247.55
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
57652818
EC Number:
201-864-3
Beilstein/REAXYS Number:
1588666
MDL number:
MFCD00036216
Assay:
≥98.0% (HPLC)
Form:
lumps

Key Documents

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InChI key

HJRJRUMKQCMYDL-UHFFFAOYSA-N

InChI

1S/C6H2ClN3O6/c7-6-4(9(13)14)1-3(8(11)12)2-5(6)10(15)16/h1-2H

SMILES string

[O-][N+](=O)c1cc(c(Cl)c(c1)[N+]([O-])=O)[N+]([O-])=O

assay

≥98.0% (HPLC)

form

lumps

functional group

chloro, nitro

Quality Level

100

Other Notes

moistened with ~15% water

signalword

Danger

Hazard Classifications

Acute Tox. 1 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Flam. Sol. 1

supp_hazards

EUH001,EUH044

Storage Class

4.1B - Flammable solid hazardous materials

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
STBL4815
STBL0325
STBK9745
STBK3491
STBK0641

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M Hagiyama et al.
The British journal of dermatology, 168(4), 771-778 (2012-10-31)
Neuroimmunological disorders are involved in the pathogenesis of atopic dermatitis (AD), partly through enhanced sensory nerve-skin mast cell interaction. Cell adhesion molecule 1 (CADM1) is a mast-cell adhesion molecule that mediates the adhesion to, and communication with, sympathetic nerves. To
Andreas Natsch et al.
Chemical research in toxicology, 24(11), 2018-2027 (2011-10-26)
The skin sensitization potency of chemicals is partly related to their reactivity to proteins. This can be quantified as the rate constant of the reaction with a model peptide, and a kinetic profiling approach to determine rate constants was previously
Atsuto Ogata et al.
International immunopharmacology, 11(10), 1628-1632 (2011-06-07)
A chymase inhibitor SUN13834 has been shown to improve skin condition in animal models for atopic dermatitis. In the present study, effective dosages of SUN13834 for atopic dermatitis patients were predicted by pharmacokinetic/pharmacodynamic (PK/PD) analyses of SUN13834 in NC/Nga mice
Eujin Cho et al.
Journal of ethnopharmacology, 145(1), 294-302 (2012-11-15)
Korean red ginseng (KRG) has been shown to possess various biological activities including anti-inflammatory properties. We aimed to investigate the effects and mechanism of KRG on the prevention of atopic dermatitis (AD) using a mouse model. The effect of KRG
T Fukuyama et al.
Toxicology letters, 213(3), 392-401 (2012-07-31)
Immunosuppressive environmental chemicals may exacerbate allergic diseases, including atopic dermatitis (AD). We examined the effects of the immunosuppressive environmental chemicals methoxychlor, parathion, piperonyl butoxide, dexamethasone, and cyclophosphamide on picryl-chloride-induced AD in NC/Nga mice. Mice were orally exposed (age, 5 weeks)
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