(2S)-2-Amino-1-(1,3-dihydro-2H-isoindol-2-yl)-1-propanone(CAS番号:1562427-43-3)

基本情報

(2S)-2-Amino-1-(1,3-dihydro-2H-isoindol-2-yl)-1-propanone

CAS番号

1562427-43-3

分子式

C11H14N2O

分子量

190.25 g/mol

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基本的な物理特性

沸点

362.6±42.0 °C(Predicted)

密度

1.178±0.06 g/cm3(Predicted)

SMILES

CC(C(=O)N1CC2=CC=CC=C2C1)N

InChI

InChI=1S/C11H14N2O/c1-8(12)11(14)13-6-9-4-2-3-5-10(9)7-13/h2-5,8H,6-7,12H2,1H3/t8-/m0/s1

InChIKey

ROGSNODZJLQUKG-QMMMGPOBSA-N

LogP

0.8759999999999996

pKa

8.46±0.29(Predicted)

トポロジカル極性表面積

46.330000000000005 Ų

水素結合ドナー/アクセプター

2 / 3

複雑度

215

分類と用途

安全情報

安全情報を表示

同義語と参考文献

英語

  • AKOS011514629
  • 1562427-43-3
  • (2S)-2-amino-1-(2,3-dihydro-1H-isoindol-2-yl)propan-1-one
  • (S)-2-Amino-1-(isoindolin-2-yl)propan-1-one
  • CS-0266921
  • EN300-193008
  • 1-Propanone, 2-amino-1-(1,3-dihydro-2H-isoindol-2-yl)-, (2S)-

MDL_Number

MFCD16692354

CAS番号

1562427-43-3

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