4-Chloro-3-Formylcoumarin 4-氯-3-甲酰基香豆素

CAS 50329-91-4 MFCD00179896

化学结构图

50329-91-4
SMILES: O=C1OC2=CC=CC=C2C(Cl)=C1C=O

化学属性

Mol. FormulaC10H5ClO3
Mol. Weight208.60
Melting Point126-130 °C(lit.)

别名和识别编码

Chemical Name4-Chloro-3-Formylcoumarin
CAS Number50329-91-4
Alfabeta NameCHLOROOXOCHROMENECARBALDEHYDE H4223-------
MDL NumberMFCD00179896
PubChem Substance ID24879107
Synonym 4-氯-3-甲酰基香豆素
Chemical Name Translation4-氯-3-甲酰基香豆素
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分类

  • {KO} ReacChlorides
  • Aldehydes, Building Blocks, C10-C12, Carbonyl Compounds, Chemical Synthesis, Coumarins, Halogenated Heterocycles, Heterocyclic Building Blocks, Organic Building Blocks
  • {KO} Aldehydes
  • {SNA} Aldehydes, Building Blocks, C10-C12, Carbonyl Compounds, Chemical Synthesis, Coumarins, Halogenated Heterocycles, Heterocyclic Building Blocks, Organic Building Blocks

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。
  • P305+P351+P338
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;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
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

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
1
H-bond Donors
0
LogP
1

系列性分类


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