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Merck
CN

232742

Sigma-Aldrich

3-羟基-6-甲基-2-硝基吡啶

99%

别名:

6-甲基-2-硝基-3-吡啶醇

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About This Item

经验公式(希尔记法):
C6H6N2O3
CAS号:
分子量:
154.12
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

检测方案

99%

形式

powder

mp

106-107 °C (lit.)

SMILES字符串

Cc1ccc(O)c(n1)[N+]([O-])=O

InChI

1S/C6H6N2O3/c1-4-2-3-5(9)6(7-4)8(10)11/h2-3,9H,1H3

InChI key

WZMGQHIBXUAYGS-UHFFFAOYSA-N

一般描述

Molecular structure and corresponding vibrational assignments of 3-hydroxy-6-methyl-2-nitropyridine have been investigated using density functional theory (DFT).

应用

3-Hydroxy-6-methyl-2-nitropyridine was used in the synthesis of 3-methoxy-6-methyl-2-nitropyridine.

象形图

Exclamation mark

警示用语:

Warning

危险声明

危险分类

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

靶器官

Respiratory system

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

dust mask type N95 (US), Eyeshields, Gloves

法规信息

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Nucleophilic aromatic substitution by [18F] fluoride at substituted 2-nitropyridines.
Malik N, et al.
J. Radioanal. Nucl. Chem., 283(3), 757-764 (2010)
M Karnan et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 96, 51-62 (2012-06-05)
The optimized molecular structure and corresponding vibrational assignments of 3-hydroxy-6-methyl-2-nitropyridine have been investigated using density functional theory (DFT) B3LYP method with 6-311++G(d,p), 6-311++G(2d,2p) and 6-311++G(3d,3p) basis sets. Investigation of the relative orientation of the hydroxyl group with respect to the

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