6-Bromoindole-2-Carboxylic Acid 6-溴吲哚-2-甲酸

CAS 16732-65-3 MFCD02664469

化学结构图

16732-65-3
SMILES: O=C(O)c1cc2ccc(Br)cc2[nH]1

化学属性

Mol. FormulaC9
Mol. Weight240
Melting Point221-223°
Density1.422

别名和识别编码

Chemical Name6-Bromoindole-2-Carboxylic Acid
CAS Number16732-65-3
Alfabeta NameBROMOINDOLECARBOXYLICACID H612-----
MDL NumberMFCD02664469
EC Number250-023-7
Beilstein Registry Number2384789
Synonym 1H-INDOLE-2-CARBOXYLIC ACID, 6-BROMO- 6-BROMO-1H-INDOLE-2-CARBOXYLIC ACID 6-BROMO-2-INDOLECARBOXYLIC ACID 6-BROMOINDOLE-2-CARBOXYLIC ACID 6-BROMOINDOLE-2-CARBOXYLIC ACID 98% 6-Bromoindole-2-carboxylic acid ,99% 6-bromoindole-2-carboxylic acid 6-溴吲哚-2-羧酸 AKOS JY2083011 Bromoindole-2-carboxylic acid
Chemical Name Translation6-溴吲哚-2-甲酸
PubChem Substance ID253661991
Reaxys-RN152677
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分类

  • {KO} AminesSecondaryHeteroNH
  • {KO} ReacBromides
  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C7 to C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • 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+P337+P313
Hazard Codes Xi
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤

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
2
H-bond Acceptors
2
Rotatable Bonds
1
LogP
2

系列性分类

  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. Indoles 吲哚
  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. Indolines 吲哚啉
  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. Indoles 吲哚
  5. C7 to C9 - Indoles
  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. Heterocyclic Acids 杂环酸
  5. Indole Acids

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