6,8-Dibromo-2-Oxo-2H-Chromene-3-Carboxylic Acid 6,8-二溴-2-氧代-2H-苯并吡喃-3-羧酸

CAS 3855-87-6 MFCD00173735

化学结构图

3855-87-6
SMILES: O=C(O)c1cc2cc(Br)cc(Br)c2oc1=O

化学属性

Mol. FormulaC10H4Br2O4
Mol. Weight347.94
Melting Point221-224 °C
TSCANo
Boiling Point483.2±45.0 °C at 760 mmHg

别名和识别编码

Chemical Name6,8-Dibromo-2-Oxo-2H-Chromene-3-Carboxylic Acid
CAS Number3855-87-6
Alfabeta NameDIBROMOOXOCHROMENECARBOXYLICACID H68223-------,
MDL NumberMFCD00173735
Synonym 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6,8-Dibromo-2-oxo-2H-chromene-3-car
Chemical Name Translation6,8-二溴-2-氧代-2H-苯并吡喃-3-羧酸
LabNetwork Molecule IDLN00144827
PubChem Substance ID725495
InChIInChI=1S/C10H4Br2O4/c11-5-1-4-2-6(9(13)14)10(15)16-8(4)7(12)3-5/h1-3H,(H,13,14)
Canonical SMILESC1=C2C=C(C(=O)O)C(=O)OC2=C(C=C1Br)Br
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分类

  • {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
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
1
H-bond Donors
1
LogP
2

系列性分类

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