2-Mercapto-5-nitropyridine 5-硝基-2-巯基吡啶

CAS 2127-09-5 MFCD00030890

化学结构图

2127-09-5
SMILES: O=[N+]([O-])c1ccc(=S)[nH]c1

化学属性

Mol. FormulaC5H4N2O2S
Mol. Weight156.16
Melting Point169-173°
Boiling Point220°C at 760 mmHg

别名和识别编码

Chemical Name2-Mercapto-5-nitropyridine
CAS Number2127-09-5
Alfabeta NameNITROPYRIDINETHIOL 52---
MDL NumberMFCD00030890
Reaxys-RN120454
Beilstein Registry Number21(3/4)390
PubChem Substance ID87573068
Chemical Name Translation5-硝基-2-巯基吡啶
Synonym 5-Nitropyridine-2(1H)-thione {LY} 5-Nitropyridine-2(1H)-thione {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitropyridine-2(1H)-thi
LabNetwork Molecule IDLN00148453
InChIInChI=1S/C5H4N2O2S/c8-7(9)4-1-2-5(10)6-3-4/h1-3H,(H,6,10)
Canonical SMILESS=C1C=CC([N+]([O-])=O)=CN1
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分类

  • {KO} Nitros
  • {KO} Thiols

安全信息

Warnings IRRITANT
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
0
H-bond Donors
1
LogP
1

其他信息

  • TCI Shanghai:2-巯基-5-硝基吡啶 2-Mercapto-5-nitropyridine,>;98.0%(T)(2127-09-5)
  • MOL 文件:2127-09-5.mol
  • 2-巯基-5-硝基吡啶价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1102 2-巯基-5-硝基吡啶 2-Mercapto-5-nitropyridine 10G 2420元

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyridines 吡啶

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