Morpholino(4-nitrophenyl)methanone 4-吗啉基（4-硝基苯基）甲酮

CAS 5397-76-2 MFCD00451121

化学结构图

5397-76-2
SMILES: O=C(c1ccc([N+](=O)[O-])cc1)N1CCOCC1

化学属性

Mol. FormulaC11H12N2O4
Mol. Weight236.22
Melting Point100-103 °C

别名和识别编码

Chemical NameMorpholino(4-nitrophenyl)methanone
CAS Number5397-76-2
Alfabeta NameMORPHOLINONITROPHENYLMETHANONE 4()-
MDL NumberMFCD00451121
Chemical Name Translation4-吗啉基（4-硝基苯基）甲酮
LabNetwork Molecule IDLN00148974
PubChem Substance ID220838
InChIInChI=1S/C11H12N2O4/c14-11(12-5-7-17-8-6-12)9-1-3-10(4-2-9)13(15)16/h1-4H,5-8H2
Synonym 4-Morpholinyl(4-nitrophenyl)methanone {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-nitrophenyl)methanone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Morpholinyl(4-ni
Canonical SMILESC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)N2CCOCC2
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分类

  • {KO} Nitros
  • {KO} Ketones

安全信息

Warnings IRRITANT
Storage condition

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
0
LogP
9.842000000000000e-001

系列性分类

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