4-Pyrazoleboronic acid pinacol ester 4-吡唑硼酸频哪醇酯

CAS 269410-08-4 MFCD03453063

化学结构图

269410-08-4
SMILES: CC1(C)OB(c2cn[nH]c2)OC1(C)C

化学属性

Mol. FormulaC9H15BN2O2
Mol. Weight194.04
Melting Point142-146°C
TSCANo
Density1.422
Appearance off-white to tan pwdr.
Danger-Level-
pH-:-
Redox-

别名和识别编码

Chemical Name4-吡唑硼酸频哪醇酯
CAS Number269410-08-4
Alfabeta NamePYRAZOLEBORONICACIDPINACOLESTER 4-
MDL NumberMFCD03453063
Synonym 1H-Pyrazole-4-boronic acid pinacol ester {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic acid pinacol ester {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Pyrazole-4-boronic
PubChem Substance ID125307795
EC Number250-023-7
Beilstein Registry Number2384789
Reaxys-RN11072822
Chemical Name Translation4-吡唑硼酸频哪醇酯
LabNetwork Molecule IDLN00171707
Canonical SMILESCC1(C)C(C)(C)OB(C2=CNN=C2)O1
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分类

  • {SNA} Boronate Esters, Boronic Acids and Derivatives, Chemical Synthesis, Heteroaryl Boronate Esters, Organometallic Reagents
  • Intermediates
  • Heterocycles
  • Boron Derivatives
  • Aromatics

产品应用

  • 4-Pyrazoleboronic Acid Pinacol Ester is used in the preparation of Rho kinase (ROCK) inhibitors as wella s other biologically active compounds.

相关文献及参考

  • Chowdhury, S. et al.: Bioorg. Med. Chem. Lett., 21, 7107 (2011);

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
Signal word Warning
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • 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;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • 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;
  • S37 Wear suitable gloves 戴适当手套;
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
Hazard Codes Xi
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Restrict -

系列性分类


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