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Merck

367699

Sigma-Aldrich

4-甲基-2-硝基苯甲醚

99%

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About This Item

线性分子式:
CH3C6H3(NO2)OCH3
CAS号:
分子量:
167.16
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

化驗

99%

形狀

liquid

折射率

n20/D 1.557 (lit.)

bp

154 °C/14 mmHg (lit.)

mp

8-9 °C (lit.)

密度

1.205 g/mL at 25 °C (lit.)

SMILES 字串

COc1ccc(C)cc1[N+]([O-])=O

InChI

1S/C8H9NO3/c1-6-3-4-8(12-2)7(5-6)9(10)11/h3-5H,1-2H3

InChI 密鑰

LGNMURXRPLMVJI-UHFFFAOYSA-N

一般說明

Nucleophilic substitution reactions of 4-methyl-2-nitroanisole in neat cyclohexylamine and piperidine have been reported.

應用

4-Methyl-2-nitroanisole may be used in the synthesis of 1-dibromomethyl-4-methoxy-2-nitrobenzene.

象形圖

Exclamation mark

訊號詞

Warning

危險聲明

危險分類

Acute Tox. 4 Oral

儲存類別代碼

10 - Combustible liquids

水污染物質分類(WGK)

WGK 3

閃點(°F)

235.4 °F - closed cup

閃點(°C)

113 °C - closed cup

個人防護裝備

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


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Theoretical calculations of chemical interactions. Part 4. Aromatic nucleophilic substitutions and SN 2 reactions of 4-and 6-substituted 2-nitroanisoles.
Nudelman NS and Palleros DR.
J. Chem. Soc. Perkin Trans. II, 6, 805-809 (1985)
Hoong-Kun Fun et al.
Acta crystallographica. Section E, Structure reports online, 65(Pt 9), o2193-o2194 (2009-01-01)
The asymmetric unit of the title compound, C(8)H(7)Br(2)NO(3), comprises two crystallographically independent mol-ecules (A and B). The nitro groups are twisted from the attached benzene rings, making dihedral angles of 39.26 (9) and 35.90 (9)° in mol-ecules A and B, respectively. In
Yusuke Yamamoto et al.
The Journal of toxicological sciences, 44(9), 585-600 (2019-09-03)
Amino acid derivative reactivity assay (ADRA) has previously been developed as an alternative method to direct peptide reactivity assay (DPRA) to evaluate key event 1 in skin sensitization mechanisms. However, when using alternative methods for skin sensitization, integrated approaches to

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