Methyl 2-(3-fluorophenyl)acetate 甲基3-氟苯酚乙酯

CAS 64123-77-9 MFCD03093288

化学结构图

64123-77-9
SMILES: COC(=O)CC1C=CC=C(F)C=1

化学属性

Mol. FormulaC9H9FO2
Mol. Weight168
Melting PointOil (°C)
Refractive index1.4860 to 1.4900

别名和识别编码

Chemical NameMethyl 2-(3-fluorophenyl)acetate
CAS Number64123-77-9
Alfabeta NameMETHYLFLUOROPHENYLACETATE 23()--
MDL NumberMFCD03093288
Synonym methyl 3-fluorophenylacetate
Chemical Name Translation甲基3-氟苯酚乙酯
PubChem Substance ID253662531
Reaxys-RN5862529
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分类

  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C8-C12, Chemical Synthesis, Fluorinated Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {KO} Esters

安全信息

Warnings IRRITANT
GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • 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。
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
WGK Germany3
Signal word Warning
Hazard statements
  • H227 Combustible liquid 可燃液体
  • H302 Harmful if swallowed 吞食有害
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害

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
2
Rotatable Bonds
3
H-bond Donors
0
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Aryl Fluorinated Building Blocks 芳基氟化物
  7. C8-C12 - Aryl Fluorinated Building Blocks
  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. Esters - Carbonyl Compounds

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