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Merck
CN

36070

2,6-Dichloro-4-nitrophenol

98%

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About This Item

Empirical Formula (Hill Notation):
C6H3Cl2NO3
CAS Number:
618-80-4
Molecular Weight:
208.00
EC Number:
210-563-6
UNSPSC Code:
12352100
PubChem Substance ID:
57649441
Beilstein/REAXYS Number:
1245045
MDL number:
MFCD00014715
Assay:
≥97.5% (HPLC), 98%
Form:
solid

Key Documents

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InChI key

PXSGFTWBZNPNIC-UHFFFAOYSA-N

InChI

1S/C6H3Cl2NO3/c7-4-1-3(9(11)12)2-5(8)6(4)10/h1-2,10H

SMILES string

Oc1c(Cl)cc(cc1Cl)[N+]([O-])=O

assay

≥97.5% (HPLC), 98%

form

solid

mp

123-126 °C (dec.)

solubility

methanol: soluble 1 g/10 mL, clear, slightly yellow to deep greenish-yellow

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pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

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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Certificates of Analysis (COA)

Lot/Batch Number
BCBJ9934V
BCBF6288V
1402975

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S K Hong et al.
Journal of toxicology and environmental health. Part A, 57(1), 47-62 (1999-05-13)
The agricultural fungicide N-(3,5-dichlorophenyl)succinimide (NDPS) is an acute nephrotoxicant in rats. Our previous studies suggested that sulfate conjugation of NDPS metabolites might be a bioactivation step mediating NDPS nephrotoxicity. In this study, effects of substrates and/or inhibitors of sulfation on
T Walle et al.
Biochemical pharmacology, 50(5), 731-734 (1995-08-25)
The natural product quercetin was a potent inhibitor of the human P-form phenolsulfo-transferase with an IC50 value of 0.10 +/- 0.03 microM (mean +/- SEM; N = 5), which was three to four orders of magnitude more potent than its
V M Seah et al.
Biochemical pharmacology, 47(10), 1743-1749 (1994-05-18)
2,6-Dichloro-4-nitrophenol (DCNP)-35sulfate was identified and quantified by an HPLC-radiometric assay following its biosynthesis in vitro from 35S-labeled 3'-phosphoadenosine-5'-phosphosulfate (PAP35S) by phenolsulfotransferase (PST) of rat liver cytosol. Acid hydrolysis of DCNP-35sulfate produced almost stoichiometric release of inorganic 35sulfate and DCNP. In
H Koster et al.
Biochemical pharmacology, 31(10), 1919-1924 (1982-05-15)
The pharmacokinetics of 2,6-dichloro-4-nitrophenol (DCNP) have been studied in the rat. Upon i.v. injection the plasma decay curve of DCNP showed a rapid distribution phase. After 30 min the plasma concentration reached a value that was constant for at least
Xingxing Diao et al.
Drug metabolism and disposition: the biological fate of chemicals, 42(4), 774-781 (2014-01-29)
3-n-Butylphthalide (NBP) [(±)-3-butyl-1(3H)-isobenzofuranone] is an anti-cerebral-ischemia drug. Moderate hepatotoxicity has been observed in clinical applications. One of the major metabolites, 3-N-acetylcysteine-NBP, has been detected in human urine, indicating the formation of a reactive metabolite. We elucidated the formation mechanism of
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