2-(P-Tolyl)Thiazole-4-Carboxylic Acid 2-(对甲苯基)噻唑-4-羧酸

CAS 17228-99-8 MFCD01936002

化学结构图

17228-99-8
SMILES: CC1C=CC(=CC=1)C1=NC(=CS1)C(O)=O

化学属性

Mol. FormulaC11H9NO2S
Mol. Weight219.26
Melting Point176-178°
TSCANo

别名和识别编码

Chemical Name2-(P-Tolyl)Thiazole-4-Carboxylic Acid
CAS Number17228-99-8
Alfabeta NameMETHYLPHENYLTHIAZOLECARBOXYLICACID 24134()------,
MDL NumberMFCD01936002
Synonym 2-(4-methylphenyl)-1,3-thiazole-4-carboxylic acid 2-(p-Tolyl)thiazole-4-carboxylic acid
PubChem Substance ID329789528
Chemical Name Translation2-(对甲苯基)噻唑-4-羧酸
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分类

  • {SNA} Building Blocks, C10 to C11, Chemical Synthesis, Heterocyclic Building Blocks, Thiazoles
  • {KO} CarboxylicAcids

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
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
GHS Symbol
WGK Germany3
Signal word Warning
Hazard Codes Xn
Hazard statements
  • H302 Harmful if swallowed 吞食有害

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
3
Rotatable Bonds
2
H-bond Donors
1
LogP
3

系列性分类


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