3-(4-Fluorophenyl)-1H-Pyrazole-4-Carbaldehyde 3-(4-氟丙基)-1H-吡唑-4-甲醛

CAS 306936-57-2 MFCD01922131

化学结构图

306936-57-2
SMILES: O=CC1=CNN=C1C1C=CC(F)=CC=1

化学属性

Mol. FormulaC10H7FN2O
Mol. Weight190
Melting Point154-155
Density1.422
TSCANo

别名和识别编码

Chemical Name3-(4-Fluorophenyl)-1H-Pyrazole-4-Carbaldehyde
CAS Number306936-57-2
Alfabeta NameFLUOROPHENYLPYRAZOLECARBALDEHYDE H3414()------
MDL NumberMFCD01922131
PubChem Substance ID354335601
EC Number250-023-7
Beilstein Registry Number2384789
Chemical Name Translation3-(4-氟丙基)-1H-吡唑-4-甲醛
Synonym 3-(4-氟苯基)-1H-吡唑-4-甲醛
Reaxys-RN10532710
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分类

  • {SNA} Aldehydes,
  • Aldehydes, Building Blocks, C10, C10-C12, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Halogenated Heterocycles, Heterocyclic Building Blocks, Heterocyclic Fluorinated Building Blocks, Organic Building Blocks, Other Fluorinated Heterocycles, Pyrazoles
  • {SNA} Aldehydes, Building Blocks, C10, C10-C12, C10-C30+, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Halogenated Heterocycles, Heterocyclic Building Blocks, Heterocyclic Fluorinated Building Blocks, Organic Building Blocks,

相关文献及参考

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
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
Hazard Codes Xi
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；
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 Air Sensitive

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 Donors
1
H-bond Acceptors
2
Rotatable Bonds
2
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes - Carbonyl Compounds
  6. C10-C12 - Aldehydes
  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. Pyrazoles 吡唑

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