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Merck
CN

N21901

4-Nitrophenyl phenyl ether

98%

Synonym(s):

1-Nitro-4-phenoxybenzene, 4-Nitrodiphenyl ether

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About This Item

Linear Formula:
O2NC6H4OC6H5
CAS Number:
Molecular Weight:
215.20
EC Number:
210-656-1
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
2051911
MDL number:
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assay

98%

bp

320 °C (lit.)

mp

53-56 °C (lit.)

SMILES string

[O-][N+](=O)c1ccc(Oc2ccccc2)cc1

InChI

1S/C12H9NO3/c14-13(15)10-6-8-12(9-7-10)16-11-4-2-1-3-5-11/h1-9H

InChI key

JDTMUJBWSGNMGR-UHFFFAOYSA-N

pictograms

Environment

hcodes

Hazard Classifications

Aquatic Chronic 2

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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R L Gupta et al.
Toxicology letters, 34(1), 13-21 (1986-11-01)
The mutagenic potential of 4-nitrodiphenyl ether (NDE) an intermediate of herbicides and an anthelmintic drug, and its reduced products (-NO, -NHOH) were investigated in the Ames test. All the three compounds were potent direct-acting base-pair and frameshift mutagens with activity
M Miyauchi et al.
Chemico-biological interactions, 51(1), 49-62 (1984-09-01)
A series of possible metabolites--4-nitrosobiphenyl ether (4-NO), 4-hydroxylaminobiphenyl ether (4-NHOH), 4-aminobiphenyl ether (4-NH2), 4-hydroxyacetylaminobiphenyl ether (4-N(OH)Ac), 4-acetoxyacetylaminobiphenyl ether (4-N(OAc)Ac)involved in the toxic effects of 4-nitrobiphenyl ether (4-NO2) was synthesized and tested for mutagenic activity toward Salmonella typhimurium TA100 strain in

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