2-Methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 154365-40-9 MFCD04124544

化学结构图

154365-40-9
SMILES: CC1(OC2=CC=CC=C2NC1=O)C(O)=O

化学属性

Mol. FormulaC10H9NO4
Mol. Weight207.18
Melting Point192-194°

别名和识别编码

Chemical Name2-Methyl-3-oxo-3,4-dihydro-2H-benzo[1,4]oxazine-2-carboxylic acid
CAS Number154365-40-9
Alfabeta NameMETHYLOXODIHYDROBENZOXAZINECARBOXYLICACID H23342142----------,,
MDL NumberMFCD04124544
Synonym 2-Methyl-3-oxo-3,4-dihydro-2H-benzo[1,4]oxazine-2-carboxylic acid
Chemical Name Translation
PubChem Substance ID329790631
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分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Amines, Building Blocks, C10, Chemical Synthesis, Ethers, Nitrogen Compounds, Organic Building Blocks, Oxygen Compounds
  • {KO} CarboxylicAcids

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P305+P351+P338
Signal word Warning
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;
Hazard Codes Xn
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
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 Donors
2
H-bond Acceptors
4
Rotatable Bonds
1
LogP
5.407000000000001e-001

系列性分类


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