Methyl 3-(2-bromoethoxy)benzenecarboxylate

CAS 59516-96-0 MFCD06204041

化学结构图

59516-96-0
SMILES: COC(=O)C1C=C(C=CC=1)OCCBr

化学属性

Mol. FormulaC10H11BrO3
Mol. Weight259
Boiling Point110°/0.05mm
TSCANo
Melting PointBP: 110 @ 0.05 mbar (°C)

别名和识别编码

Chemical Namemethyl 3-(2-bromoethoxy)benzoate
CAS Number59516-96-0
Alfabeta NameMETHYLBROMOETHOXYBENZENECARBOXYLATE 32()--
MDL NumberMFCD06204041
Synonym 3-(2-Bromoethoxy)benzoic acid methyl ester
PubChem Substance ID329788561
Chemical Name Translation
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分类

  • Building Blocks, C10, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, New Products for Chemical Synthesis, Organic Building Blocks
  • {KO} ReacBromides
  • {SNA} Building Blocks, C10, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Bl

安全信息

Warnings IRRITANT
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；
  • 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
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
GHS Symbol
WGK Germany3
Precautionary statements
  • P305+P351+P338
Signal word Warning
Hazard Codes Xn
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
5
H-bond Donors
0
LogP
2

系列性分类

  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. Carboxylic Acids - Carbonyl Compounds
  6. C10 - Carboxylic Acids

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